Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 11/20 | 0.49 |
| ▸ | KIT | P10721 | 1/20 | 0.46 |
| ▸ | MAPK11 | Q15759 | 4/20 | 0.46 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | CSF1R | P07333 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19993538 | 0.85 | MAPK14 (0.34) | MAPK14KITMAPK11HSPB1CYP2C9 | |
| SCHEMBL19993520 | 0.80 | MAPK14 (0.50) | MAPK14KITMAPK11HSPB1CYP2C9 | |
| SCHEMBL19993497 | 0.77 | HDAC8 (0.39) | NPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL10282601 | 0.77 | GLA (0.64) | MAPK14MAPK11HSPB1CYP2C9NPC1 | |
| SCHEMBL23591986 | 0.76 | MAPK11 (0.60) | MAPK14MAPK11 | |
| SCHEMBL14308374 | 0.75 | MAPK14 (0.50) | MAPK14MAPK11HSPB1CYP2C9NPC1 | |
| SCHEMBL14048887 | 0.75 | MAPK14 (0.48) | MAPK14KITMAPK11HSPB1CYP2C9 | |
| SCHEMBL2948427 | 0.74 | MAPK14 (0.58) | MAPK14MAPK11HSPB1CYP2C9NPC1 | |
| SCHEMBL25548 | 0.74 | MAPK14 (0.58) | MAPK14MAPK11HSPB1CYP2C9NPC1 | |
| SCHEMBL15653186 | 0.73 | MAPK14 (0.54) | MAPK14MAPK11HSPB1CYP2C9NPC1 |
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-2018052772-A1 | HETEROARYL CARBOXAMIDE COMPOUNDS AS INHIBITORS OF RIPK2 | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2018-03-22 | — | — | WO | disclosed |