Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.68 |
| ▸ | HTT | P42858 | 2/20 | 0.68 |
| ▸ | GAA | P10253 | 2/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.68 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.56 |
| ▸ | FLT1 | P17948 | 1/20 | 0.56 |
| ▸ | GAPDH | P04406 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL7975272 | 0.87 | ITK (0.63) | KDM4EALDH1A1HTTGAACYP1A2 | |
| SCHEMBL16258965 | 0.86 | PDPK1 (0.56) | KDM4EALDH1A1HTTGAACYP1A2 | |
| SCHEMBL7972894 | 0.85 | KDM4E (0.51) | KDM4EALDH1A1HTTGAACYP1A2 | |
| SCHEMBL10139790 | 0.84 | F9 (0.56) | KDM4EALDH1A1HTTGAACYP1A2 | |
| SCHEMBL10139794 | 0.84 | F9 (0.56) | KDM4EALDH1A1HTTGAACYP1A2 | |
| SCHEMBL10172578 | 0.84 | F9 (0.56) | KDM4EALDH1A1HTTGAACYP1A2 | |
| SCHEMBL7982406 | 0.84 | KDM4E (0.50) | KDM4EALDH1A1HTTGAACYP1A2 | |
| SCHEMBL7973109 | 0.83 | F10 (0.52) | KDM4EALDH1A1HTTGAACYP1A2 | |
| SCHEMBL10139787 | 0.81 | KDM4E (0.58) | KDM4EALDH1A1HTTGAACYP1A2 | |
| SCHEMBL7979283 | 0.81 | KDM4E (0.47) | KDM4EALDH1A1HTTGAACYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2805939-A1 | Heterocyclic compounds as factor IXA inhibitors. | Merck Sharp & Dohme Corp. (US) | 2014-11-26 | — | — | EP | disclosed |
| WO-2009143039-A2 | HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS | SCHERING CORPORATION (US) | 2009-11-26 | — | — | WO | disclosed |