Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 8/20 | 0.35 |
| ▸ | CDK9 | P50750 | 8/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16803037 | 0.82 | LMNA (0.40) | LMNAGRM1CCNT1CDK9KDM4E | |
| SCHEMBL7704571 | 0.81 | GRM1 (0.34) | LMNATSHRGRM1CCNT1CDK9 | |
| SCHEMBL2547779 | 0.81 | CDK9 (0.48) | TSHRCCNT1CDK9RORCALOX15 | |
| SCHEMBL2547781 | 0.81 | CDK9 (0.48) | TSHRCCNT1CDK9RORCALOX15 | |
| SCHEMBL19189827 | 0.79 | GRM1 (0.45) | GRM1CCNT1CDK9RORC | |
| SCHEMBL26157240 | 0.75 | LMNA (0.36) | LMNATSHRGRM1CCNT1CDK9 | |
| SCHEMBL16803086 | 0.75 | CYP3A4 (0.40) | KDM4ECYP2C19ALDH1A1 | |
| SCHEMBL22794705 | 0.73 | SORD (0.34) | CCNT1CDK9 | |
| SCHEMBL20437876 | 0.70 | LMNA (0.42) | LMNATSHRTRPA1ALOX15CYP1B1 | |
| SCHEMBL20066515 | 0.70 | CCNT1 (0.45) | CCNT1CDK9 |
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-2560975-B1 | HETEROARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2015-06-17 | — | — | EP | disclosed |