Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 8/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.45 |
| ▸ | MAPT | P10636 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MITF | O75030 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | PHGDH | O43175 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9818865 | 1.00 | ABCG2 (0.50) | ABCG2MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL9818928 | 0.89 | EPHX2 (0.50) | NPC1RAB9AEPHX2TRPV1 | |
| SCHEMBL9819417 | 0.87 | KIF11 (0.50) | ABCG2MEN1KMT2AMAPTMITF | |
| SCHEMBL9819349 | 0.87 | MEN1 (0.50) | ABCG2MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL9819042 | 0.86 | MAOB (0.47) | MEN1KMT2AMITFNPC1RAB9A | |
| SCHEMBL9818907 | 0.86 | MAOB (0.47) | MEN1KMT2AMITFNPC1RAB9A | |
| SCHEMBL9819219 | 0.84 | AR (0.48) | MEN1KMT2AMAPTALDH1A1POLB | |
| SCHEMBL9818871 | 0.84 | AR (0.59) | MAPTALDH1A1MAPK1HTTLMNA | |
| SCHEMBL9819032 | 0.83 | MLYCD (0.52) | NPC1RAB9ARXFP1EPHX2TRPV1 | |
| SCHEMBL9819165 | 0.83 | RHOC (0.49) | MEN1KMT2ANPC1RAB9ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5034410-A | Nitrile and oxo containing amides or thioamides | SYNTEX (U.S.A.) INC. (US) | 1991-07-23 | — | — | US | disclosed |