Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRHDE | Q9UKU6 | 1/20 | 0.57 |
| ▸ | CPB2 | Q96IY4 | 8/20 | 0.52 |
| ▸ | CPB1 | P15086 | 1/20 | 0.50 |
| ▸ | TRHR | P34981 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 4/20 | 0.45 |
| ▸ | KDM5A | P29375 | 1/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.43 |
| ▸ | FNTA | P49354 | 1/20 | 0.42 |
| ▸ | FNTB | P49356 | 1/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HPGDS | O60760 | 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 | |
|---|---|---|---|---|
| SCHEMBL26931596 | 0.89 | TRHDE (0.56) | TRHDECPB2CPB1TRHRKDM5A | |
| SCHEMBL3842771 | 0.87 | CPB2 (0.71) | TRHDECPB2CPB1TRHRKDM5A | |
| SCHEMBL21673119 | 0.86 | TRHDE (0.58) | TRHDECPB2CPB1TRHRKDM5A | |
| SCHEMBL24004542 | 0.84 | TRHDE (0.56) | TRHDECPB2CPB1TRHRSIRT2 | |
| SCHEMBL755381 | 0.82 | TRHDE (0.54) | TRHDECPB2CPB1TRHRKDM5A | |
| SCHEMBL29692716 | 0.82 | TRHDE (0.56) | TRHDECPB2CPB1TRHRKDM5A | |
| SCHEMBL8248813 | 0.81 | TRHDE (0.61) | TRHDECPB2CPB1TRHR | |
| SCHEMBL5870099 | 0.81 | TRHDE (0.61) | TRHDECPB2CPB1TRHR | |
| SCHEMBL8249152 | 0.81 | TRHDE (0.61) | TRHDECPB2CPB1TRHR | |
| SCHEMBL31035995 | 0.80 | TRHDE (0.52) | TRHDE |
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 |
|---|---|---|---|---|---|---|---|
| US-4560515-A | NON-SYMMETRICAL KETENE REACTED WITH A-HYDROXYNITRILE; TERTUARY AMINE CATALYST | SHELL OIL COMPANY (US) | 1985-12-24 | — | — | US | disclosed |