Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.41 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.41 |
| ▸ | MPO | P05164 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29508230 | 0.89 | CYP1A2 (0.53) | P2RX7SMN1; SMN2NPC1RAB9ANAMPT | |
| SCHEMBL917137 | 0.89 | CYP1A2 (0.53) | P2RX7SMN1; SMN2NPC1RAB9ANAMPT | |
| Hydrochloric Acid SCHEMBL27922723 | 0.88 | CYP1A2 (0.51) | P2RX7SMN1; SMN2NPC1RAB9ANAMPT | |
| SCHEMBL107554 | 0.84 | P2RX7 (1.00) | P2RX7KMT2ACYP1A2KDM4EGRM4 | |
| SCHEMBL31627592 | 0.84 | P2RX7 (1.00) | P2RX7KMT2ACYP1A2KDM4EGRM4 | |
| SCHEMBL27283920 | 0.77 | P2RX7 (0.49) | P2RX7SMN1; SMN2NPC1RAB9ACYP1A2 | |
| SCHEMBL27798556 | 0.77 | P2RX7 (0.56) | P2RX7GRM4ALDH1A1 | |
| SCHEMBL7023361 | 0.77 | P2RX7 (0.45) | P2RX7SMN1; SMN2NAMPTCYP1A2CDC7 | |
| SCHEMBL22619714 | 0.76 | P2RX7 (0.53) | P2RX7SMN1; SMN2NPC1RAB9ANAMPT | |
| SCHEMBL27287621 | 0.76 | P2RX7 (0.51) | P2RX7GRM4GAA |
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-112313224-A | ATF6 inhibitors and uses thereof | 黑带医疗有限责任公司 | 2021-02-02 | — | — | CN | disclosed |