Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | RXRA | P19793 | 4/20 | 0.48 |
| ▸ | RXRB | P28702 | 3/20 | 0.48 |
| ▸ | KMO | O15229 | 1/20 | 0.46 |
| ▸ | COMT | P21964 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 2/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | STIM1 | Q13586 | 1/20 | 0.38 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | MYC | P01106 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2712235 | 0.90 | KMT2A (0.58) | MEN1KMT2ANPC1RAB9ARXRA | |
| SCHEMBL16775438 | 0.89 | RXRA (0.52) | MEN1KMT2ANPC1RAB9ARXRA | |
| SCHEMBL16775437 | 0.89 | RXRA (0.49) | MEN1KMT2ANPC1RAB9ARXRA | |
| SCHEMBL2710486 | 0.82 | KMO (0.59) | MEN1KMT2ANPC1RAB9ARXRA | |
| SCHEMBL181903 | 0.81 | MEN1 (0.53) | MEN1KMT2ANPC1RAB9ARXRA | |
| SCHEMBL2709784 | 0.81 | RXRA (0.62) | MEN1KMT2ANPC1RAB9ARXRA | |
| SCHEMBL2710952 | 0.81 | KMO (0.47) | MEN1KMT2ANPC1RAB9ARXRA | |
| SCHEMBL182067 | 0.81 | KMO (0.47) | MEN1KMT2ARXRARXRBKMO | |
| SCHEMBL17125395 | 0.80 | MEN1 (0.77) | MEN1KMT2ANPC1RAB9ARXRA | |
| SCHEMBL2707679 | 0.79 | STIM1 (0.58) | MEN1KMT2ANPC1RAB9AKMO |
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-9051342-B2 | Pyrazole or triazole compounds and their use for the manufacture of a medicament for treating somatic mutation related diseases | PTC THERAPEUTICS, INC. (US) | 2015-06-09 | — | — | US | disclosed |