Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CMA1 | P23946 | 1/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | PNMT | P11086 | 10/20 | 0.37 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.34 |
| ▸ | TDP2 | O95551 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17242469 | 0.79 | KDM4E (0.42) | — | |
| SCHEMBL9082663 | 0.79 | CMA1 (0.43) | CMA1AHRPNMTASIC3ADRA2A | |
| SCHEMBL20080101 | 0.73 | BRD4 (0.43) | AHRBRD4 | |
| SCHEMBL17099478 | 0.70 | CMA1 (0.46) | CMA1AHRPNMTASIC3ADRA2A | |
| SCHEMBL17436480 | 0.70 | AHR (0.42) | CMA1AHRPNMTASIC3ADRA2A | |
| SCHEMBL26145032 | 0.70 | CMA1 (0.35) | CMA1AHRPARP10TDP2PARP1 | |
| SCHEMBL17436026 | 0.68 | CMA1 (0.40) | CMA1AHRPNMTASIC3ADRA2A | |
| SCHEMBL1612916 | 0.67 | PNMT (0.57) | CMA1AHRPNMTASIC3ADRA2A | |
| SCHEMBL29414378 | 0.67 | PNMT (0.57) | CMA1AHRPNMTASIC3ADRA2A | |
| SCHEMBL31076226 | 0.67 | BRD4 (0.41) | CMA1AHRPNMTASIC3ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015170266-A1 | SUBSTITUTED PYRIMIDINE COMPOUNDS AS BTK INHIBITORS | LUPIN LIMITED (IN) | 2015-11-12 | — | — | WO | disclosed |