Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.81 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.78 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.78 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.78 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.74 |
| ▸ | HPGD | P15428 | 3/20 | 0.74 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.74 |
| ▸ | APP | P05067 | 2/20 | 0.74 |
| ▸ | MEN1 | O00255 | 2/20 | 0.74 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.70 |
| ▸ | NPC1 | O15118 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 1/20 | 0.62 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.62 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.62 |
| ▸ | ITGAL | P20701 | 1/20 | 0.62 |
| ▸ | MAOB | P27338 | 2/20 | 0.61 |
| ▸ | BCHE | P06276 | 1/20 | 0.61 |
| ▸ | MAOA | P21397 | 1/20 | 0.61 |
| ▸ | ACHE | P22303 | 1/20 | 0.61 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL9363901 | 1.00 | TRPV1 (0.81) | TRPV1KDM4EALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL2122038 | 0.90 | TRPV1 (1.00) | TRPV1KDM4EALDH1A1KMT2AHPGD | |
| SCHEMBL2122045 | 0.90 | TRPV1 (1.00) | TRPV1KDM4EALDH1A1KMT2AHPGD | |
| SCHEMBL8077987 | 0.87 | TRPV1 (0.66) | TRPV1KDM4EALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL8077994 | 0.87 | TRPV1 (0.66) | TRPV1KDM4EALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL15110739 | 0.87 | TRPV1 (0.69) | TRPV1KDM4EALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL15110741 | 0.87 | TRPV1 (0.69) | TRPV1KDM4EALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL3121297 | 0.86 | KDM4E (0.97) | TRPV1KDM4EALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL3121290 | 0.86 | KDM4E (0.97) | TRPV1KDM4EALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL11469833 | 0.85 | KDM4E (0.80) | TRPV1KDM4EALDH1A1KMT2AL3MBTL1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0219756-B1 | Acrylic amides | SHELL INT RESEARCH (NL) | 1994-01-05 | — | — | EP | claimed |
| EP-0219756-A1 | Acrylic amides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-04-29 | — | — | EP | claimed |
| EP-0219756-B1 | Acrylic amides | SHELL INT RESEARCH (NL) | 1994-01-05 | — | — | EP | disclosed |
| US-4910200-A | Agricultural fungicide | CELAMERCK GMBH & CO. KG (DE) | 1990-03-20 | — | — | US | disclosed |
| EP-0219756-A1 | Acrylic amides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1987-04-29 | — | — | EP | disclosed |