Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.65 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | AOC3 | Q16853 | 4/20 | 0.53 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8255372 | 0.83 | SIGMAR1 (0.69) | SIGMAR1TAAR1KDM4EAOC3ADRA2B | |
| SCHEMBL24201077 | 0.81 | KDM4E (0.59) | SIGMAR1TAAR1KDM4EADRA2BADRA2C | |
| SCHEMBL27885210 | 0.80 | SIGMAR1 (0.65) | SIGMAR1TAAR1KDM4EAOC3 | |
| SCHEMBL19498789 | 0.78 | SIGMAR1 (1.00) | SIGMAR1TAAR1KDM4EAOC3ADRA2B | |
| SCHEMBL19498804 | 0.78 | KDM4E (0.81) | SIGMAR1TAAR1KDM4EAOC3ADRA2B | |
| SCHEMBL7141888 | 0.77 | SIGMAR1 (0.61) | SIGMAR1TAAR1KDM4EAOC3 | |
| SCHEMBL27817329 | 0.77 | SIGMAR1 (0.56) | SIGMAR1TAAR1KDM4EAOC3 | |
| SCHEMBL8805158 | 0.74 | SIGMAR1 (0.58) | SIGMAR1TAAR1KDM4EAOC3SLC6A2 | |
| SCHEMBL1311254 | 0.74 | SIGMAR1 (0.57) | SIGMAR1TAAR1KDM4EAOC3 | |
| SCHEMBL22863888 | 0.73 | TAAR1 (1.00) | SIGMAR1TAAR1AOC3 |
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-9914740-B2 | Tricyclic pyrido-carboxamide derivatives as rock inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-03-13 | — | — | US | disclosed |