Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | WRN | Q14191 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | SI | P14410 | 1/20 | 0.38 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.38 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL11292223 | 1.00 | NAAA (0.44) | NAAAALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL8744195 | 1.00 | NAAA (0.44) | NAAAALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL8961878 | 0.93 | PTGS1 (0.40) | NAAAALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL30902248 | 0.91 | ALDH1A1 (0.44) | NAAAALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL30902264 | 0.91 | ALDH1A1 (0.44) | NAAAALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL2039597 | 0.89 | NAAA (0.42) | NAAAALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL873462 | 0.89 | NAAA (0.42) | NAAAALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL21467458 | 0.89 | NAAA (0.38) | NAAAALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL873463 | 0.89 | NAAA (0.42) | NAAAALDH1A1CYP1A2HPGDCYP2C19 | |
| SCHEMBL1695314 | 0.87 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4544767-A | HYDROGENATION CATALYST | PHILLIPS PETROLEUM COMPANY (US) | 1985-10-01 | — | — | US | claimed |
| US-4182901-A | AND SUITABLE CARBOXYLIC ACID | PHILLIPS PETROLEUM COMPANY (US) | 1980-01-08 | — | — | US | claimed |
| US-4095030-A | CARBOXYLIC ACID SALTS, DILUENTS | PHILLIPS PETROLEUM COMPANY (US) | 1978-06-13 | — | — | US | claimed |
| EP-0612720-B1 | Process for producing 1,4-dicyano-2-butene | SUMITOMO CHEMICAL CO (JP) | 1997-01-08 | — | — | EP | disclosed |
| US-5463103-A | Reacting butene derivative with hydrogen cyanide in presence of catalyst prepared from cuprous halide, lower alkylamine hydrohalide and Lewis acid or basic acetate, carbonate or bicarbonate | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1995-10-31 | — | — | US | disclosed |
| EP-0612720-A1 | Process for producing 1,4-dicyano-2-butene | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1994-08-31 | — | — | EP | disclosed |
| US-4806679-A | GAS OR LIQUID PHASE CATALYSIS WITH ZEOLITE; INTERMEDIATES | BASF AKTIENGESELLSCHAFT (DE) | 1989-02-21 | — | — | US | disclosed |
| EP-0132737-B1 | PROCESS FOR THE ISOMERIZATION OF DIACYLOXYBUTENES | BASF Aktiengesellschaft (DE) | 1988-01-07 | — | — | EP | disclosed |
| US-4544767-A | HYDROGENATION CATALYST | PHILLIPS PETROLEUM COMPANY (US) | 1985-10-01 | — | — | US | disclosed |
| EP-0132737-A2 | Process for the isomerization of diacyloxybutenes | BASF Aktiengesellschaft (DE) | 1985-02-13 | — | — | EP | disclosed |
| US-4238356-A | REACTION PRODUCT OF A CARBOXYLIC ACID, SELENIUM DIOXIDE, A HYDROXIDE OR ACID SALT, AND AN ACID ANHYDRIDE | PHILLIPS PETROLEUM COMPANY (US) | 1980-12-09 | — | — | US | disclosed |
| US-4182901-A | AND SUITABLE CARBOXYLIC ACID | PHILLIPS PETROLEUM COMPANY (US) | 1980-01-08 | — | — | US | disclosed |
| US-4124619-A | Preparation of esters of hydroxy tiglic aldehyde | HOFFMANN-LA ROCHE INC. (US) | 1978-11-07 | — | — | US | disclosed |
| US-4095030-A | CARBOXYLIC ACID SALTS, DILUENTS | PHILLIPS PETROLEUM COMPANY (US) | 1978-06-13 | — | — | US | disclosed |