Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 7/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | GUSB | P08236 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.37 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29002513 | 1.00 | TRPV1 (0.47) | TRPV1KDM4EHSD17B10LMNAACVR1 | |
| SCHEMBL29002558 | 0.80 | CASR (0.38) | MEN1KMT2ACASR | |
| SCHEMBL30454826 | 0.77 | HSD17B10 (0.49) | TRPV1KDM4EHSD17B10LMNAACVR1 | |
| SCHEMBL30454449 | 0.71 | KDM4E (0.49) | TRPV1KDM4EHSD17B10LMNAACVR1 | |
| Ammonia Solution, Strong SCHEMBL3162475 | 0.69 | APLNR (0.50) | KDM4ELMNAMEN1KMT2ACYP1A2 | |
| SCHEMBL29002566 | 0.69 | PYCR1 (0.41) | KDM4ELMNAPOLBALDH1A1MAPT | |
| SCHEMBL30455640 | 0.67 | KDM4E (0.46) | TRPV1KDM4EHSD17B10LMNAACVR1 | |
| SCHEMBL29002511 | 0.67 | KDM4E (0.46) | TRPV1KDM4EHSD17B10LMNAACVR1 | |
| SCHEMBL1257374 | 0.65 | KDM4E (1.00) | TRPV1KDM4EHSD17B10LMNAGUSB | |
| SCHEMBL29900577 | 0.65 | KDM4E (1.00) | TRPV1KDM4EHSD17B10LMNAGUSB |
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 |
|---|---|---|---|---|---|---|---|
| CN-116143708-A | Polysubstituted benzazepine heteroaryl derivative and application thereof | 四川汇宇制药股份有限公司 | 2023-05-23 | — | — | CN | disclosed |