Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 7/20 | 0.40 |
| ▸ | RAB9A | P51151 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL287555 | 0.86 | PDCD1 (0.39) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL287282 | 0.85 | TDP1 (0.43) | NPC1RAB9AALDH1A1SMN1; SMN2HPGD | |
| Methyl Benzoate SCHEMBL28281001 | 0.65 | TSHR (0.95) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 | |
| SCHEMBL11021070 | 0.64 | TSHR (0.76) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 | |
| Methyl Benzoate SCHEMBL9130151 | 0.63 | TSHR (0.91) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 | |
| Methyl Benzoate SCHEMBL29105567 | 0.62 | TSHR (1.00) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 | |
| Methyl Benzoate SCHEMBL28945661 | 0.62 | TSHR (1.00) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 | |
| Methyl Benzoate SCHEMBL1867855 | 0.62 | TSHR (1.00) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 | |
| Methyl Benzoate SCHEMBL1332323 | 0.62 | TSHR (1.00) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 | |
| Methyl Benzoate SCHEMBL28537345 | 0.62 | TSHR (1.00) | TSHRNPC1RAB9AALDH1A1SMN1; SMN2 |
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-2427432-A2 | NOVEL HETEROCYCLIC COMPOUNDS | Torrent Pharmaceuticals Limited (IN) | 2012-03-14 | — | — | EP | disclosed |
| WO-2010128528-A2 | NOVEL HETEROCYCLIC COMPOUNDS | TORRENT PHARMACEUTICALS LIMITED (IN) | 2010-11-11 | — | — | WO | disclosed |