Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | NAAA | Q02083 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.43 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 2/20 | 0.41 |
| ▸ | PREP | P48147 | 2/20 | 0.41 |
| ▸ | FAP | Q12884 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9034821 | 0.98 | EPHX1 (0.61) | EPHX1SMN1; SMN2HSD17B10HDAC6HDAC8 | |
| SCHEMBL4390738 | 0.98 | EPHX1 (0.61) | EPHX1SMN1; SMN2HSD17B10HDAC6HDAC8 | |
| SCHEMBL2223174 | 0.95 | — | — | |
| SCHEMBL290144 | 0.90 | — | — | |
| SCHEMBL9035265 | 0.82 | NAAA (0.55) | EPHX1SMN1; SMN2HSD17B10HDAC6HDAC8 | |
| SCHEMBL1740262 | 0.80 | NAAA (0.58) | EPHX1SMN1; SMN2HSD17B10HDAC6HDAC8 | |
| SCHEMBL9034554 | 0.80 | NAAA (0.58) | EPHX1SMN1; SMN2HSD17B10HDAC6HDAC8 | |
| SCHEMBL4396852 | 0.80 | KMT2A (0.48) | EPHX1SMN1; SMN2HSD17B10NAAAKMT2A | |
| SCHEMBL2115641 | 0.79 | NAAA (0.61) | EPHX1SMN1; SMN2HSD17B10HDAC6HDAC8 | |
| SCHEMBL19757607 | 0.78 | EPHX1 (0.65) | EPHX1SMN1; SMN2HSD17B10HDAC6HDAC8 |
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-0721454-A1 | NEW PYRAZOLE DERIVATIVES AS ANGIOTENSIN II ANTAGONIST | J. URIACH & CIA. S.A. (ES) | 1996-07-17 | — | — | EP | disclosed |
| US-5157034-A | Neuroleptic perhydro-1H-pyrido[1,2-a]pyrazines | PFIZER INC. (US) | 1992-10-20 | — | — | US | disclosed |