Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 13/20 | 0.52 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.44 |
| ▸ | NSD2 | O96028 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL82675 | 0.84 | HCAR3 (0.68) | HCAR3PTK2HCAR2KMT2A | |
| Toluene SCHEMBL9060786 | 0.82 | HCAR3 (0.63) | HCAR3PTK2SMN1; SMN2HCAR2NSD2 | |
| SCHEMBL27347169 | 0.80 | HCAR3 (0.55) | HCAR3PTK2HCAR2ADORA3ADORA2A | |
| Pyridine SCHEMBL5437479 | 0.79 | HCAR3 (0.59) | HCAR3PTK2HCAR2NSD2KMT2A | |
| SCHEMBL27347795 | 0.76 | HCAR3 (0.52) | HCAR3PTK2NPC1SMN1; SMN2HCAR2 | |
| SCHEMBL27343709 | 0.76 | KDM4E (0.62) | HCAR3PTK2NPC1SMN1; SMN2HCAR2 | |
| SCHEMBL27349315 | 0.74 | HCAR3 (0.50) | HCAR3PTK2HCAR2NSD2ADORA3 | |
| SCHEMBL7093993 | 0.73 | PTK2 (0.62) | HCAR3PTK2SMN1; SMN2NSD2ADORA3 | |
| SCHEMBL28118455 | 0.73 | PTK2 (0.54) | HCAR3PTK2KMT2A | |
| SCHEMBL5237534 | 0.72 | SMN1; SMN2 (0.58) | HCAR3NPC1SMN1; SMN2KMT2ARAB9A |
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-1061658-C | Tricyclic benzazepine vasopressin antagonists | AMERICAN CYANAMID CO (US) | 2001-02-07 | — | — | CN | disclosed |