Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18801309 | 0.89 | CA12 (0.57) | SMN1; SMN2NPC1RAB9AL3MBTL1CA12 | |
| SCHEMBL18801490 | 0.85 | SMN1; SMN2 (0.44) | SMN1; SMN2NPC1RAB9AHDAC1HDAC6 | |
| SCHEMBL26746820 | 0.84 | CA12 (0.57) | SMN1; SMN2NPC1RAB9AL3MBTL1KDM4E | |
| SCHEMBL18801347 | 0.80 | L3MBTL1 (0.48) | SMN1; SMN2NPC1RAB9AL3MBTL1KDM4E | |
| SCHEMBL24169594 | 0.79 | HDAC1 (0.59) | SMN1; SMN2HDAC1HDAC6KDM4ECA12 | |
| SCHEMBL8611008 | 0.78 | SMN1; SMN2 (0.55) | SMN1; SMN2NPC1RAB9AL3MBTL1CA12 | |
| SCHEMBL10741549 | 0.78 | HSP90AA1 (0.56) | NPC1RAB9AHDAC1HDAC6CYP1A2 | |
| SCHEMBL12772497 | 0.78 | L3MBTL1 (0.47) | SMN1; SMN2NPC1RAB9AL3MBTL1KDM4E | |
| SCHEMBL31123647 | 0.78 | L3MBTL1 (0.58) | SMN1; SMN2NPC1RAB9AL3MBTL1KDM4E | |
| SCHEMBL11274332 | 0.78 | L3MBTL1 (0.58) | SMN1; SMN2NPC1RAB9AL3MBTL1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2486004-B1 | SULPHONE COMPOUNDS FOR USE IN THE TREATMENT OF OBESITY | ZAFGEN INC (US) | 2017-05-03 | — | — | EP | disclosed |