Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | RBP4 | P02753 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4070097 | 0.90 | AKR1C3 (0.46) | AKR1C3TTRHSD11B1HTR1ATRPV1 | |
| SCHEMBL23211918 | 0.82 | AKR1C3 (0.54) | AKR1C3TTRHSD11B1HTR1ATRPV1 | |
| SCHEMBL22669019 | 0.82 | AKR1C3 (0.54) | AKR1C3TTRHSD11B1HTR1ATRPV1 | |
| SCHEMBL30407607 | 0.82 | AKR1C3 (0.54) | AKR1C3TTRHSD11B1HTR1ATRPV1 | |
| SCHEMBL27647544 | 0.80 | AKR1C3 (0.53) | AKR1C3TTRHSD11B1HTR1ATRPV1 | |
| SCHEMBL6914239 | 0.79 | AKR1C3 (0.46) | AKR1C3TTRHSD11B1HTR1ATRPV1 | |
| SCHEMBL4064652 | 0.79 | AKR1C3 (0.51) | AKR1C3TTRHSD11B1HTR1ATRPV1 | |
| SCHEMBL4069218 | 0.77 | SMN1; SMN2 (0.44) | KMT2AALDH1A1MEN1LMNACYP1A2 | |
| SCHEMBL4792071 | 0.76 | AKR1C3 (0.51) | AKR1C3TTRHSD11B1HTR1ATRPV1 | |
| SCHEMBL4068610 | 0.75 | ADRB1 (0.48) | AKR1C3HTR1AALDH1A1LMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1415986-B1 | SPIRO ISOBENZOFURANES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS | BANYU PHARMA CO LTD (JP) | 2009-04-08 | — | — | EP | disclosed |
| US-7205417-B2 | Spiro compounds | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2007-04-17 | — | — | US | disclosed |