Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | GMNN | O75496 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2126233 | 0.88 | HPGD (0.53) | CYP2A6TDP1HPGDALDH1A1MAPT | |
| SCHEMBL8755670 | 0.86 | NPSR1 (0.47) | CYP2A6TDP1HPGDALDH1A1MAPT | |
| SCHEMBL15759867 | 0.80 | CYP2A6 (0.50) | CYP2A6TDP1ALDH1A1MAPTMAPK1 | |
| SCHEMBL15040985 | 0.77 | ALDH1A1 (0.61) | CYP2A6TDP1HPGDALDH1A1MAPT | |
| SCHEMBL28656428 | 0.76 | ALDH1A1 (0.46) | CYP2A6TDP1HPGDALDH1A1MAPT | |
| SCHEMBL14036119 | 0.76 | RAB9A (0.66) | CYP2A6TDP1HPGDALDH1A1LMNA | |
| SCHEMBL931068 | 0.76 | ALDH1A1 (0.52) | CYP2A6HPGDALDH1A1CYP1A2LMNA | |
| Beta-Naphtoic Acid SCHEMBL9101990 | 0.76 | CYP2A6 (0.63) | CYP2A6TDP1HPGDALDH1A1MAPT | |
| SCHEMBL26016720 | 0.76 | SMN1; SMN2 (0.59) | TDP1HPGDALDH1A1MAPTLMNA | |
| SCHEMBL8707349 | 0.75 | ALDH1A1 (0.45) | CYP2A6TDP1HPGDALDH1A1MAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1039811-C | Naphthalene dicarboxylic acids and esters substituted with aroyl group | EASTMAN CHEM CO (US) | 1998-09-16 | — | — | CN | disclosed |
| CN-1136804-A | Naphthalene dicarboxylic acids and esters substituted with aroyl group | EASTMAN CHEM CO (US) | 1996-11-27 | — | — | CN | disclosed |
| EP-0731783-A1 | NAPHTHALENE DICARBOXYLIC ACIDS AND ESTERS SUBSTITUTED WITH AROYL GROUPS | EASTMAN CHEMICAL COMPANY (US) | 1996-09-18 | — | — | EP | disclosed |
| WO-1995015304-A1 | NAPHTHALENE DICARBOXYLIC ACIDS AND ESTERS SUBSTITUTED WITH AROYL GROUPS | EASTMAN CHEMICAL COMPANY (US) | 1995-06-08 | — | — | WO | disclosed |
| US-5352761-A | Incorporated into polyesters for reduced fluorescence | EASTMAN CHEMICAL COMPANY (US) | 1994-10-04 | — | — | US | disclosed |