Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9211054 | 0.90 | LMNA (0.44) | ESR1RAB9ANPC1SMN1; SMN2MAPT | |
| SCHEMBL9277725 | 0.89 | ESR1 (0.51) | ESR1RAB9ANPC1SMN1; SMN2MAPT | |
| SCHEMBL9217238 | 0.82 | SMN1; SMN2 (0.40) | RAB9ANPC1SMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL9217990 | 0.81 | NPC1 (0.39) | RAB9ANPC1SMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL9212327 | 0.80 | ADORA3 (0.38) | ESR1RAB9ANPC1SMN1; SMN2MAPT | |
| SCHEMBL9218231 | 0.80 | NPC1 (0.38) | RAB9ANPC1SMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL9210936 | 0.79 | MAPT (0.40) | RAB9ANPC1SMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL9264401 | 0.78 | ENPP2 (0.46) | RAB9ANPC1SMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL9253405 | 0.78 | NPC1 (0.37) | RAB9ANPC1SMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL9210165 | 0.76 | ALDH1A1 (0.43) | RAB9ANPC1SMN1; SMN2MAPTCYP1A2 |
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-5475000-A | Antiulcer agents | CHINOIN GYOGYSZER-ES VEGYESZETI TERMEKEK GYARA RT. (HU) | 1995-12-12 | — | — | US | disclosed |