Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | PHGDH | O43175 | 5/20 | 0.48 |
| ▸ | CNR2 | P34972 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL7390182 | 0.89 | CNR2 (0.43) | TRPA1PHGDHCNR2 | |
| SCHEMBL8498386 | 0.89 | MEN1 (0.52) | TRPA1PHGDHMEN1KMT2AHDAC1 | |
| SCHEMBL8525886 | 0.89 | MEN1 (0.44) | TRPA1PHGDHCNR2MEN1KMT2A | |
| SCHEMBL7387721 | 0.88 | CNR2 (0.48) | TRPA1PHGDHCNR2MEN1KMT2A | |
| SCHEMBL7387938 | 0.86 | TRPA1 (0.49) | TRPA1PHGDHCNR2MEN1KMT2A | |
| SCHEMBL7390768 | 0.81 | KDM4E (0.42) | CNR2 | |
| SCHEMBL7389883 | 0.80 | CNR1 (0.38) | CNR2MEN1KMT2ANPC1 | |
| SCHEMBL5668257 | 0.79 | TRPA1 (0.52) | TRPA1PHGDHCNR2MEN1KMT2A | |
| SCHEMBL8499206 | 0.78 | CNR1 (0.36) | CNR2MEN1KMT2A | |
| SCHEMBL8501439 | 0.78 | TRPA1 (0.51) | TRPA1PHGDHCNR2MEN1KMT2A |
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-5877197-A | C-terminal modified (N-substituted)-2-indolyl dipeptides as inhibitors of the ICE/ced-3 family of cysteine proteases | CONATUS PHARMACEUTICALS, INC. | 1999-03-02 | — | — | US | disclosed |