Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | XIAP | P98170 | 1/20 | 0.35 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL317651 | 0.84 | ADORA1 (0.43) | SMN1; SMN2ADORA1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3925148 | 0.82 | ADORA1 (0.44) | SMN1; SMN2ADORA1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4171284 | 0.82 | CHRNB2 (0.51) | SMN1; SMN2ADORA1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL18158005 | 0.81 | XIAP (0.36) | SMN1; SMN2ADORA1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3935296 | 0.81 | ADORA1 (0.43) | SMN1; SMN2ADORA1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10278878 | 0.81 | ADORA1 (0.43) | SMN1; SMN2ADORA1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL317679 | 0.81 | ADORA1 (0.43) | SMN1; SMN2ADORA1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL21211527 | 0.81 | ADORA1 (0.43) | SMN1; SMN2ADORA1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL921576 | 0.79 | L3MBTL1 (0.54) | SMN1; SMN2ADORA1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL124547 | 0.78 | CYP1A2 (0.44) | SMN1; SMN2ADORA1CYP1A2CYP3A4CYP2C9 |
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-4772619-A | ANTIULCER AGENTS | G. D. SEARLE & CO. (US) | 1988-09-20 | — | — | US | disclosed |