Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | HTR2B | P41595 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | DAO | P14920 | 2/20 | 0.43 |
| ▸ | ACP3 | P15309 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL23927275 | 0.82 | TAAR1 (0.58) | HTR2AHTR2BHTR2CEPHX1TRPV1 | |
| SCHEMBL15023045 | 0.80 | TAAR1 (0.62) | HTR2AHTR2BHTR2CEPHX1TRPV1 | |
| SCHEMBL9626110 | 0.80 | TP53 (0.48) | TAAR1IDO1DAORAB9ACDC7 | |
| SCHEMBL1723183 | 0.77 | TAAR1 (0.62) | HTR2AHTR2BHTR2CTAAR1IDO1 | |
| SCHEMBL31404219 | 0.76 | TAAR1 (0.61) | HTR2AHTR2BHTR2CEPHX1TAAR1 | |
| SCHEMBL7519147 | 0.76 | HTR2A (0.53) | HTR2AHTR2BHTR2CEPHX1TAAR1 | |
| SCHEMBL1145949 | 0.75 | TAAR1 (0.55) | HTR2AHTR2BHTR2CEPHX1TAAR1 | |
| SCHEMBL7391468 | 0.75 | CYP2C19 (0.50) | LMNAMAPT | |
| SCHEMBL23927281 | 0.75 | TAAR1 (0.58) | HTR2AHTR2BHTR2CEPHX1TAAR1 | |
| SCHEMBL3119866 | 0.73 | TAAR1 (0.67) | HTR2AHTR2BHTR2CTAAR1IDO1 |
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-0326297-B1 | THIOFORMAMIDE DERIVATIVES | MAY & BAKER LIMITED (GB) | 1992-03-18 | — | — | EP | disclosed |
| US-4959385-A | MUSCLE RELAXANTS | MAY & BAKER LIMITED (GB) | 1990-09-25 | — | — | US | disclosed |
| EP-0326297-A1 | Thioformamide derivatives | MAY & BAKER LIMITED (GB) | 1989-08-02 | — | — | EP | disclosed |