Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | PNMT | P11086 | 3/20 | 0.37 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25405473 | 0.85 | ASIC3 (0.55) | NPC1NISCHCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL5912311 | 0.80 | CYP2D6 (0.40) | CYP2D6SLC6A2SLC6A4SLC6A3PNMT | |
| SCHEMBL5850255 | 0.74 | NPC1 (0.79) | NPC1NISCHCA12CA1CA2 | |
| SCHEMBL24222564 | 0.72 | ABCB1 (0.53) | NPC1NISCHSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL30481091 | 0.70 | PNMT (0.44) | ASIC3PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL6313377 | 0.70 | PNMT (0.44) | ASIC3PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL6308292 | 0.70 | PNMT (0.44) | ASIC3PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL10200729 | 0.69 | NISCH (0.42) | NPC1NISCHCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL25452806 | 0.69 | ADRA2A (0.54) | NPC1NISCHCYP2D6SLC6A2SLC6A4 | |
| SCHEMBL18554694 | 0.69 | ASIC3 (0.49) | ASIC3PNMTADRA2AADRA2BADRA2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-3464270-B1 | HETEROCYCLIC INHIBITORS OF CBP/EP300 AND THEIR USE IN THE TREATMENT OF CANCER | GENENTECH INC (US) | 2022-02-23 | — | — | EP | disclosed |