Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WDR5 | P61964 | 1/20 | 0.42 |
| ▸ | LDHA | P00338 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CDC25B | P30305 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8089174 | 0.92 | WDR5 (0.46) | WDR5LDHACYP1A2CYP2C19MEN1 | |
| SCHEMBL8085668 | 0.90 | WDR5 (0.45) | WDR5LDHACYP1A2CYP2C19MEN1 | |
| Di(Hydroxyethyl)Ether SCHEMBL8085670 | 0.88 | WDR5 (0.51) | WDR5LDHACYP1A2CYP2C19MEN1 | |
| SCHEMBL6279953 | 0.83 | ALDH1A1 (0.45) | WDR5LDHAKMT2AKDM4EALDH1A1 | |
| SCHEMBL8416453 | 0.82 | WDR5 (0.43) | WDR5LDHACYP1A2CYP2C19MEN1 | |
| SCHEMBL21312087 | 0.82 | HRH3 (0.52) | CYP1A2CYP2C19KMT2AKDM4EALDH1A1 | |
| SCHEMBL21312665 | 0.82 | HRH3 (0.52) | CYP1A2CYP2C19KMT2AKDM4EALDH1A1 | |
| SCHEMBL21312110 | 0.82 | HRH3 (0.52) | CYP1A2CYP2C19KMT2AKDM4EALDH1A1 | |
| SCHEMBL3397194 | 0.81 | WDR5 (0.50) | WDR5LDHACYP1A2CYP2C19MEN1 | |
| SCHEMBL8643540 | 0.80 | TSHR (0.59) | KDM4EALDH1A1HSD17B10CDC25BLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6100374-A | HYDROGENATING IMPURITIES, CONTACTING WITH SULFITE AND/OR HYDROLYZING | MITSUI CHEMICALS INC. (JP) | 2000-08-08 | — | — | US | disclosed |
| EP-0926124-A1 | METHOD FOR PURIFYING CRUDE NAPHTHALENEDICARBOXYLIC ACID AND PROCESS FOR PREPARING POLYETHYLENE NAPHTHALATE | Mitsui Chemicals, Inc. (JP) | 1999-06-30 | — | — | EP | disclosed |