Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.57 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.44 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.44 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.39 |
| ▸ | KCNAB1 | Q14722 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18824341 | 0.94 | ALDH1A1 (0.62) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL21815402 | 0.86 | ALDH1A1 (0.57) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL18228346 | 0.84 | ALDH1A1 (0.70) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL25252374 | 0.81 | ALDH1A1 (0.52) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL1250612 | 0.81 | ALDH1A1 (0.53) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL1250614 | 0.81 | ALDH1A1 (0.53) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL23877964 | 0.81 | ALDH1A1 (0.67) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL25410750 | 0.79 | ALDH1A1 (0.48) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL31693805 | 0.78 | ALDH1A1 (0.64) | ALDH1A1F2PRSS1PRSS2PRSS3 | |
| SCHEMBL18137607 | 0.78 | KMT2A (0.54) | ALDH1A1KMT2AMEN1 |
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-3891136-B1 | 4-HETEROARYLCARBONYL-N-(PHENYL OR HETEROARYL)PIPERIDINE-1-CARBOXAMIDES AS INHIBITORS OF TANKYRASES | MERCK PATENT GMBH (DE) | 2023-07-19 | — | — | EP | disclosed |