Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | JAK1 | P23458 | 1/20 | 0.44 |
| ▸ | USP9X | Q93008 | 4/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14359456 | 0.80 | LMNA (0.47) | LMNAMAPK1JAK1CHRM3CES2 | |
| SCHEMBL16365588 | 0.77 | PLA2G1B (0.51) | LMNAMAPK1JAK1 | |
| SCHEMBL7041710 | 0.77 | ALDH1A1 (0.57) | LMNAMAPK1CHRM3HSD17B10CHRM1 | |
| SCHEMBL27780237 | 0.76 | DPP4 (0.46) | LMNAMAPK1USP9XROCK2CYP3A4 | |
| SCHEMBL18171456 | 0.76 | DPP4 (0.46) | LMNAMAPK1USP9XROCK2CYP3A4 | |
| SCHEMBL7037673 | 0.76 | CHRM1 (0.45) | CHRM3CHRM1 | |
| SCHEMBL14359594 | 0.75 | ACHE (0.50) | MAPK1USP9XCHRM3ROCK2CYP3A4 | |
| SCHEMBL12744721 | 0.74 | CHRNB2 (0.60) | — | |
| SCHEMBL24322583 | 0.70 | SIGMAR1 (0.54) | LMNAMAPK1ROCK2CYP3A4 | |
| SCHEMBL18390258 | 0.70 | CHRM1 (0.63) | CHRM3CYP2D6HSD17B10ROCK2CYP3A4 |
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-2796460-B1 | PYRROLE SIX-MEMBERED HETEROARYL RING DERIVATIVE, PREPARATION METHOD THEREFOR, AND MEDICINAL USES THEREOF | JIANGSU HENGRUI MEDICINE CO (CN) | 2018-07-04 | — | — | EP | disclosed |