Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TACR1 | P25103 | 2/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6667447 | 0.91 | AKR1C3 (0.50) | AKR1C3AKR1C2MTNR1AMTNR1BTAAR1 | |
| SCHEMBL13100656 | 0.90 | MTNR1A (0.49) | MTNR1AMTNR1BTAAR1ABCB1HTR1A | |
| SCHEMBL6050076 | 0.87 | MTNR1A (0.49) | AKR1C3AKR1C2MTNR1AMTNR1BTAAR1 | |
| SCHEMBL5077290 | 0.82 | MTNR1A (0.53) | MTNR1AMTNR1B | |
| SCHEMBL9145931 | 0.80 | ALDH1A1 (0.56) | AKR1C3AKR1C2KMT2AMEN1ALDH1A1 | |
| SCHEMBL11820853 | 0.79 | ABCB1 (0.51) | AKR1C3ALDH1A1MTNR1AMTNR1BSMN1; SMN2 | |
| SCHEMBL7823381 | 0.78 | KMT2A (0.70) | AKR1C3AKR1C2KMT2ATDP1MEN1 | |
| SCHEMBL24440174 | 0.77 | TAAR1 (0.53) | MTNR1AMTNR1BTAAR1 | |
| SCHEMBL11815553 | 0.77 | MITF (0.54) | AKR1C3KMT2AMEN1ALDH1A1MTNR1A | |
| SCHEMBL16147991 | 0.76 | SLC1A5 (0.58) | MTNR1AMTNR1BTAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0163416-B1 | PHENOL DERIVATIVES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-05-31 | — | — | EP | disclosed |
| US-4751240-A | ANTIFERTILITY AGENTS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-06-14 | — | — | US | disclosed |
| EP-0163416-A2 | Phenol derivatives | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1985-12-04 | — | — | EP | disclosed |