Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | BRAF | P15056 | 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 | |
|---|---|---|---|---|
| SCHEMBL18753490 | 0.86 | DPP4 (0.45) | P2RX7USP2CYP3A4MEN1KMT2A | |
| SCHEMBL18753793 | 0.86 | CYP2D6 (0.47) | USP2CYP3A4MEN1KMT2ACYP2D6 | |
| SCHEMBL18753362 | 0.85 | PKM (0.52) | MEN1KMT2ACYP2C9 | |
| SCHEMBL18753306 | 0.84 | GBA1 (0.44) | USP2CYP3A4CYP2D6LMNANAMPT | |
| SCHEMBL18753861 | 0.84 | MGLL (0.45) | CYP2D6NAMPTCYP2C9LRRK2 | |
| SCHEMBL19562111 | 0.82 | CYP2D6 (0.43) | USP2CYP3A4MEN1KMT2ACYP2D6 | |
| SCHEMBL20750396 | 0.79 | CYP3A4 (0.51) | USP2CYP3A4MEN1KMT2ACYP2D6 | |
| SCHEMBL18753391 | 0.77 | ALDH1A1 (0.48) | MEN1KMT2ALMNACYP1A2CYP2C9 | |
| SCHEMBL2703534 | 0.76 | PKM (0.58) | — | |
| SCHEMBL18753748 | 0.76 | RBP4 (0.47) | P2RX7LMNANAMPTLRRK2 |
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-2448582-B1 | QUINOLINE-8-SULFONAMIDE DERIVATIVES HAVING AN ANTICANCER ACTIVITY | AGIOS PHARMACEUTICALS INC (US) | 2017-04-19 | — | — | EP | disclosed |