Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.38 |
| ▸ | TYMS | P04818 | 4/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | TNKS | O95271 | 2/20 | 0.35 |
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.34 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.34 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.34 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21170042 | 0.84 | PARP1 (0.46) | PARP1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL21170217 | 0.82 | PSEN1 (0.36) | MAPK14CCNT1CDK9PSEN1PSEN2 | |
| SCHEMBL2561842 | 0.82 | TNKS (0.43) | ROCK2ROCK1MAPK14TYMSJAK2 | |
| SCHEMBL21170087 | 0.80 | PSEN1 (0.41) | MAPK14PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL21170453 | 0.76 | NTRK1 (0.44) | — | |
| SCHEMBL21170452 | 0.75 | PPM1D (0.48) | MAPK14PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL21170049 | 0.74 | DYRK1A (0.38) | ROCK2ROCK1JAK2CDK9PSEN1 | |
| SCHEMBL12286540 | 0.74 | TYMS (0.37) | TYMSTRPV1JAK2TNKSPARP1 | |
| SCHEMBL21170220 | 0.74 | FAAH (0.43) | MAPK14PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL21170314 | 0.72 | NPC1 (0.41) | NPC1RAB9A |
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-3127541-B1 | CERTAIN AMINO-PYRIDAZINES, COMPOSITIONS THEREOF, AND METHODS OF THEIR USE | CYTOKINETICS INC (US) | 2019-07-17 | — | — | EP | disclosed |