Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRPF1 | P55201 | 1/20 | 0.51 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.41 |
| ▸ | GGT1 | P19440 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8927372 | 0.83 | SLC22A6 (0.50) | BRPF1SLC22A6KDM4EALDH1A1HPGD | |
| SCHEMBL27728069 | 0.82 | ALDH1A1 (0.44) | BRPF1SLC22A6KDM4EALDH1A1HPGD | |
| SCHEMBL9117976 | 0.81 | BRPF1 (0.64) | BRPF1SLC22A6KDM4EALDH1A1HPGD | |
| SCHEMBL27961376 | 0.79 | ALDH1A1 (0.61) | BRPF1SLC22A6KDM4EALDH1A1HPGD | |
| SCHEMBL27858183 | 0.78 | KDM4E (0.39) | BRPF1SLC22A6KDM4EALDH1A1HPGD | |
| SCHEMBL8926562 | 0.78 | HTR2A (0.57) | BRPF1KDM4EALDH1A1HPGDHTT | |
| SCHEMBL27612163 | 0.76 | SOS2 (0.60) | SLC22A6ACHEMTNR1AMTNR1B | |
| SCHEMBL28034293 | 0.75 | SLC22A6 (0.61) | BRPF1SLC22A6KDM4EALDH1A1HPGD | |
| SCHEMBL30630330 | 0.75 | HTR6 (0.70) | ACHEMTNR1AMTNR1B | |
| SCHEMBL27085080 | 0.75 | HTR6 (0.70) | ACHEMTNR1AMTNR1B |
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-101040037-B | Organic compounds | GIVAUDAN SA | 2010-08-18 | — | — | CN | disclosed |
| CN-101040037-A | Organic compounds | GIVAUDAN SA (CH) | 2007-09-19 | — | — | CN | disclosed |
| US-5614498-A | OLIGOPEPTIDES, BRONCHDILATORS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1997-03-25 | — | — | US | disclosed |
| US-5496928-A | Endothelin antagonistic substance | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1996-03-05 | — | — | US | disclosed |
| EP-0555537-A2 | Endothelin antagonistic substance | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1993-08-18 | — | — | EP | disclosed |