Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.36 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | MTOR | P42345 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.33 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.33 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | ATR | Q13535 | 2/20 | 0.31 |
| ▸ | ATRIP | Q8WXE1 | 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 | |
|---|---|---|---|---|
| SCHEMBL28024746 | 0.80 | PIK3CD (0.36) | PDE4DNPC1KDM4EMTORALDH1A1 | |
| SCHEMBL2084217 | 0.76 | ALDH1A1 (0.51) | KCNMA1GRM1CYP3A4CYP2D6PDE4D | |
| SCHEMBL27866878 | 0.71 | GRIN2D (0.40) | KDM4EMTORPIK3C3ATRATRIP | |
| SCHEMBL28025174 | 0.68 | CHRNB2 (0.41) | MTORPIK3C3MAPK1ATRATRIP | |
| SCHEMBL30307674 | 0.67 | KDM4E (0.47) | KCNMA1GRM1CYP3A4CYP2D6KDM4E | |
| SCHEMBL21722473 | 0.67 | KDM4E (0.47) | KCNMA1GRM1CYP3A4CYP2D6KDM4E | |
| SCHEMBL21722525 | 0.67 | GRM1 (0.45) | KCNMA1GRM1CYP3A4CYP2D6KDM4E | |
| SCHEMBL30206003 | 0.67 | AKR1C3 (0.46) | KDM4EALDH1A1HPGDHSD17B10MAPK1 | |
| SCHEMBL2084707 | 0.66 | KCNMA1 (0.48) | KCNMA1GRM1CYP3A4CYP2D6NPC1 | |
| SCHEMBL28025203 | 0.66 | ATR (0.35) | KDM4EALDH1A1PIK3C3ATRATRIP |
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 |
|---|---|---|---|---|---|---|---|
| CN-105143209-A | Biaryl amide compounds as kinase inhibitors | NOVARTIS AG | 2015-12-09 | — | — | CN | disclosed |