Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 2/20 | 0.54 |
| ▸ | TPMT | P51580 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 2/20 | 0.41 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA7 | P43166 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11257407 | 0.84 | TPMT (0.56) | TTRTPMTCYP3A4DAOHCAR1 | |
| SCHEMBL1228193 | 0.81 | AKR1C3 (0.61) | CYP3A4DAOGPR35AKR1C4AKR1C3 | |
| SCHEMBL30519485 | 0.81 | AKR1C3 (0.61) | CYP3A4DAOGPR35AKR1C4AKR1C3 | |
| SCHEMBL15796379 | 0.81 | TTR (0.56) | TTRTPMTDAOHCAR1GPR35 | |
| SCHEMBL20503756 | 0.79 | AKR1C4 (0.44) | TTRCYP3A4DAOHCAR1AKR1C4 | |
| SCHEMBL25977571 | 0.79 | TTR (0.59) | TTRTPMTHCAR1GPR35CA12 | |
| SCHEMBL3769878 | 0.78 | TTR (0.58) | TTRTPMTCYP3A4DAOHCAR1 | |
| SCHEMBL6431790 | 0.78 | TTR (0.58) | TTRTPMTHCAR1AKR1C4AKR1C3 | |
| SCHEMBL31255183 | 0.78 | TTR (0.52) | TTRTPMTDAOHCAR1GPR35 | |
| Ethane SCHEMBL27741369 | 0.78 | TTR (0.52) | TTRTPMTHCAR1GPR35AKR1C4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4042571-A | Fire-retardant polyamides from naphthalene dicarboxylic reactant and halogenated carboxylic reactant | TEIJIN LIMITED (JA) | 1977-08-16 | — | — | US | claimed |
| EP-0774458-A1 | Substituted benzodicarboxylic acid diguanidines, process for their preparation, and their use as medicament or diagnostic agent | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-05-21 | — | — | EP | disclosed |
| US-4042571-A | Fire-retardant polyamides from naphthalene dicarboxylic reactant and halogenated carboxylic reactant | TEIJIN LIMITED (JA) | 1977-08-16 | — | — | US | disclosed |