Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12530396 | 0.89 | TRPV1 (0.40) | TRPV1MEN1ALDH1A1HSP90AA1MAPT | |
| SCHEMBL15012993 | 0.77 | TRPV1 (0.38) | TRPV1MEN1ALDH1A1HSP90AA1MAPT | |
| SCHEMBL13006758 | 0.73 | MEN1 (0.55) | MEN1ALDH1A1HSP90AA1MAPTHPGD | |
| SCHEMBL13005771 | 0.72 | CYP1A2 (0.38) | TRPV1IDO1FAAHCYP1A2CYP2D6 | |
| SCHEMBL6045414 | 0.72 | CYP1A2 (0.38) | TRPV1IDO1FAAHCYP1A2CYP2D6 | |
| SCHEMBL6045415 | 0.72 | CYP1A2 (0.38) | TRPV1IDO1FAAHCYP1A2CYP2D6 | |
| SCHEMBL972580 | 0.71 | SIRT2 (0.51) | TRPV1CYP4F2CYP4A11ALDH1A1IDO1 | |
| SCHEMBL13006100 | 0.69 | SLC6A3 (0.39) | TRPV1MEN1ALDH1A1HSP90AA1MAPT | |
| SCHEMBL133271 | 0.69 | SLC6A3 (0.39) | TRPV1MEN1ALDH1A1HSP90AA1MAPT | |
| SCHEMBL7173394 | 0.69 | ALDH1A1 (0.47) | TRPV1CYP4F2CYP4A11ALDH1A1MAPT |
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-1768966-A1 | COUMPOUNDS AND METHODS FOR INHIBITING THE INTERACTION OF BCL PROTEINS WITH BINDING PARTNERS | Infinity Pharmaceuticals, Inc. (US) | 2007-04-04 | — | — | EP | disclosed |
| WO-2006009869-A1 | COUMPOUNDS AND METHODS FOR INHIBITING THE INTERACTION OF BCL PROTEINS WITH BINDING PARTNERS | INFINITY PHARMACEUTICALS, INC. (US) | 2006-01-26 | — | — | WO | disclosed |