Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 4/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | RET | P07949 | 1/20 | 0.30 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.30 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1628106 | 0.74 | KDM4E (0.40) | KDM4ECHEK1CHRM1 | |
| SCHEMBL12825489 | 0.71 | — | — | |
| SCHEMBL6364198 | 0.70 | CHRM3 (0.35) | — | |
| SCHEMBL1628690 | 0.69 | KDM4E (0.37) | KDM4E | |
| SCHEMBL11548641 | 0.69 | PRKCD (0.37) | TAAR1KDM4ECHEK1CHRM1 | |
| SCHEMBL12506114 | 0.69 | — | — | |
| SCHEMBL8201516 | 0.66 | FAAH (0.34) | CHEK1 | |
| SCHEMBL18809713 | 0.66 | — | — | |
| SCHEMBL22199979 | 0.66 | MRGPRX1 (0.51) | TRPA1KDM4EESR1 | |
| SCHEMBL395523 | 0.65 | POLB (0.39) | CHRM1 |
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-2986604-B1 | PYRIMIDINE-SUBSTITUTED PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | BOEHRINGER INGELHEIM INT (DE) | 2017-12-20 | — | — | EP | disclosed |