Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | ZAP70 | P43403 | 1/20 | 0.34 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15998127 | 0.85 | NOS1 (0.36) | NOS1ALDH1A1 | |
| SCHEMBL10002194 | 0.85 | NOS1 (0.55) | NOS1ADORA2AADORA1SRCCDK2 | |
| SCHEMBL13191843 | 0.73 | NOS1 (0.43) | NOS1ADORA2AADORA1SRCCDK2 | |
| SCHEMBL31219241 | 0.72 | NOS1 (0.48) | NOS1ADORA2AADORA1SRCCDK2 | |
| SCHEMBL1207018 | 0.71 | ALDH1A1 (0.47) | NOS1ADORA2AADORA1HDAC4ADORA3 | |
| SCHEMBL17890 | 0.70 | — | — | |
| SCHEMBL160815 | 0.70 | — | — | |
| SCHEMBL20175446 | 0.70 | NOS1 (0.44) | NOS1ADORA2AADORA1SRCCDK2 | |
| SCHEMBL2629268 | 0.70 | ADORA2A (0.45) | NOS1ADORA2AADORA1SRCCDK2 | |
| SCHEMBL3714018 | 0.69 | NOS1 (0.44) | NOS1ADORA2AADORA1SRCCDK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3306690-B1 | ORGANIC SEMICONDUCTING COMPOUNDS | RAYNERGY TEK INC (TW) | 2022-09-07 | — | — | EP | disclosed |
| EP-3306690-A1 | ORGANIC SEMICONDUCTING COMPOUNDS | Merck Patent GmbH (DE) | 2018-04-11 | — | — | EP | disclosed |