Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.48 |
| ▸ | HTR3B | O95264 | 3/20 | 0.48 |
| ▸ | HTR3A | P46098 | 3/20 | 0.48 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.48 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | AGXT | P21549 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4294493 | 0.85 | PNMT (0.68) | PNMTTSHRRECQLHTR3EHTR3B | |
| SCHEMBL28771456 | 0.82 | PNMT (0.58) | PNMTTSHRRECQLHTR3EHTR3B | |
| SCHEMBL2427261 | 0.82 | PNMT (0.69) | PNMTTSHRRECQLHTR3EHTR3B | |
| SCHEMBL8153800 | 0.82 | PNMT (0.69) | PNMTTSHRRECQLHTR3EHTR3B | |
| SCHEMBL29091904 | 0.82 | PNMT (0.58) | PNMTTSHRRECQLHTR3EHTR3B | |
| SCHEMBL28771460 | 0.82 | PNMT (0.58) | PNMTTSHRRECQLHTR3EHTR3B | |
| SCHEMBL1552426 | 0.80 | PNMT (0.56) | PNMTTSHRRECQLHTR3EHTR3B | |
| Hydrochloric Acid SCHEMBL7864518 | 0.80 | PNMT (0.67) | PNMTTSHRRECQLHTR3EHTR3B | |
| SCHEMBL30615772 | 0.80 | PNMT (0.56) | PNMTTSHRRECQLHTR3EHTR3B | |
| SCHEMBL25518189 | 0.80 | PNMT (0.56) | PNMTTSHRRECQLHTR3EHTR3B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4729994-A | Benzothiazepine vasodilators having aralkyl substitution | MCNEILAB, INC. (US) | 1988-03-08 | — | — | US | disclosed |