Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PLAT | P00750 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3560762 | 0.83 | RAB9A (0.47) | NPC1KMT2ARAB9AMEN1CA12 | |
| SCHEMBL3563825 | 0.77 | OPRM1 (0.57) | NPC1KMT2ARAB9AMEN1CA12 | |
| SCHEMBL3556100 | 0.77 | NPC1 (0.49) | NPC1KMT2ARAB9AMEN1CA12 | |
| SCHEMBL7918857 | 0.76 | ATM (0.59) | NPC1KMT2ARAB9AMEN1 | |
| SCHEMBL7910450 | 0.70 | ATM (0.61) | NPC1KMT2ARAB9AMEN1 | |
| SCHEMBL7899556 | 0.70 | OPRM1 (0.51) | OPRM1LMNA | |
| SCHEMBL3560864 | 0.70 | POLB (0.61) | NPC1KMT2ARAB9AMEN1CA12 | |
| Hydrochloric Acid SCHEMBL4713610 | 0.69 | POLB (0.60) | NPC1KMT2ARAB9AMEN1CA12 | |
| SCHEMBL13889647 | 0.68 | NPC1 (0.60) | MAPK1NPC1KMT2ARAB9AMEN1 | |
| SCHEMBL20493250 | 0.68 | OPRM1 (0.43) | NPC1KMT2ARAB9AMEN1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010054968-A1 | QUINAZOLINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-05-20 | — | — | WO | disclosed |