Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 9/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.45 |
| ▸ | AADAC | P22760 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15111213 | 0.86 | AR (0.45) | ARCYP3A4PGRCES2ABCB11 | |
| SCHEMBL142930 | 0.85 | THRB (0.44) | ALDH1A1LMNACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL3659021 | 0.83 | AR (0.47) | ARCYP3A4PGRCES2ABCB11 | |
| SCHEMBL7035586 | 0.82 | THRB (0.52) | CYP3A4ALDH1A1LMNACYP1A2CYP2C9 | |
| SCHEMBL11152796 | 0.81 | NPSR1 (0.46) | ALDH1A1LMNACYP2C19SMN1; SMN2MAPT | |
| SCHEMBL23070471 | 0.79 | NPSR1 (0.39) | CYP3A4CES2ABCB11ALDH1A1LMNA | |
| SCHEMBL11266735 | 0.79 | AR (0.42) | ARCES2ALDH1A1LMNATSHR | |
| SCHEMBL28537382 | 0.79 | THRB (0.42) | CES2ALDH1A1LMNACYP1A2CYP2C9 | |
| SCHEMBL7035878 | 0.77 | ALDH1A1 (0.52) | CYP3A4ALDH1A1LMNACYP1A2MAPK1 | |
| SCHEMBL13208348 | 0.76 | AR (0.54) | ARCYP3A4PGRCES2ABCB11 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4337264-A | ANALGESICS, ANTIINFLAMMATORY AGENTS AND FUNGICIDES | CIBA-GEIGY CORPORATION (US) | 1982-06-29 | — | — | US | disclosed |
| US-4316850-A | ANTINFLAMMATORY AGENTS | CIBA-GEIGY CORPORATION (US) | 1982-02-23 | — | — | US | disclosed |
| US-4264619-A | Tertiary aminoacids | CIBA-GEIGY CORPORATION (US) | 1981-04-28 | — | — | US | disclosed |
| US-4163788-A | ANTIINFLAMMATORY | CIBA-GEIGY CORPORATION (US) | 1979-08-07 | — | — | US | disclosed |
| US-4126691-A | ANTIINFLAMMATORY | CIBA-GEIGY CORPORATION (US) | 1978-11-21 | — | — | US | disclosed |
| US-3993763-A | ALPHA-(CYCLIC TERTIARY AMINO-PHENYL)-ALIPHATIC ACIDS | CIBA-GEIGY CORPORATION (US) | 1976-11-23 | — | — | US | disclosed |
| US-3936467-A | ANTIINFLAMMATORY | CIBA-GEIGY CORPORATION (US) | 1976-02-03 | — | — | US | disclosed |