Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9448212 | 0.86 | HTR2C (0.48) | HTR2CCYP19A1SRD5A1CA1CA2 | |
| SCHEMBL9448097 | 0.77 | HTR2C (0.44) | HTR2CCYP19A1SRD5A1CA1CA2 | |
| SCHEMBL9448284 | 0.76 | CYP19A1 (0.40) | CYP19A1PPARD | |
| SCHEMBL9448236 | 0.72 | SRD5A1 (0.42) | HTR2CSRD5A1CA1CA2CA7 | |
| SCHEMBL9448061 | 0.70 | SRD5A1 (0.44) | HTR2CCYP19A1SRD5A1ALDH1A1CYP1A2 | |
| SCHEMBL9448205 | 0.68 | SRD5A1 (0.45) | HTR2CCYP19A1SRD5A1CA1CA2 | |
| SCHEMBL9448190 | 0.67 | CYP19A1 (0.43) | CYP19A1PPARD | |
| SCHEMBL9447903 | 0.66 | HTR2C (0.50) | HTR2CCYP19A1SRD5A1 | |
| SCHEMBL9447900 | 0.66 | HTR2C (0.50) | HTR2CCYP19A1SRD5A1 | |
| SCHEMBL12844306 | 0.66 | PPARD (0.54) | HTR2CCYP19A1SRD5A1PPARD |
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-5248677-A | Nervous system disorders or antidepressants | ABBOTT LABORATORIES (US) | 1993-09-28 | — | — | US | disclosed |
| US-5180733-A | Antidepressants or nervous systen disorders | ABBOTT LABORATORIES (US) | 1993-01-19 | — | — | US | disclosed |
| EP-0461353-A1 | Biogenic amine uptake inhibitors | ABBOTT LABORATORIES (US) | 1991-12-18 | — | — | EP | disclosed |