Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.42 |
| ▸ | IL1RN | P18510 | 3/20 | 0.38 |
| ▸ | ERAP2 | Q6P179 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | SCD | O00767 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| SCHEMBL3736192 | 0.91 | CA2 (0.49) | CACNA1BIL1RNERAP2ERAP1 | |
| SCHEMBL3736195 | 0.91 | CA2 (0.49) | CACNA1BIL1RNERAP2ERAP1 | |
| SCHEMBL13062411 | 0.84 | IDE (0.40) | CYP3A4IL1RNERAP2MAPTERAP1 | |
| SCHEMBL3730039 | 0.84 | CA2 (0.43) | CACNA1B | |
| SCHEMBL3730041 | 0.84 | CA2 (0.43) | CACNA1B | |
| SCHEMBL3734511 | 0.83 | CA2 (0.51) | IL1RNERAP2ERAP1 | |
| SCHEMBL3734516 | 0.83 | CA2 (0.51) | IL1RNERAP2ERAP1 | |
| SCHEMBL13042369 | 0.82 | CA2 (0.51) | IL1RNERAP2ERAP1 | |
| SCHEMBL13012767 | 0.80 | CACNA1B (0.42) | CACNA1BMAPT | |
| SCHEMBL13078269 | 0.80 | CA2 (0.41) | — |
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-2468734-A1 | Development of molecular imaging probes for carbonic anhydrase-IX using click chemistry | Siemens Medical Solutions USA, Inc. (US) | 2012-06-27 | — | — | EP | disclosed |