Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA3 | P51812 | 6/20 | 0.65 |
| ▸ | TNF | P01375 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.53 |
| ▸ | CYP2E1 | P05181 | 3/20 | 0.53 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.53 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.53 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.53 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.52 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.49 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | CDK1 | P06493 | 1/20 | 0.47 |
| ▸ | LYN | P07948 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL21692148 | 0.95 | RPS6KA3 (0.59) | RPS6KA3TNFCYP1A2CYP3A4CYP2A6 | |
| SCHEMBL21692174 | 0.95 | RPS6KA3 (0.59) | RPS6KA3TNFCYP1A2CYP3A4CYP2A6 | |
| SCHEMBL28114956 | 0.91 | RPS6KA3 (0.62) | RPS6KA3CYP1A2CYP3A4CYP2A6CYP2E1 | |
| SCHEMBL12854062 | 0.91 | RPS6KA3 (0.56) | RPS6KA3TNFCYP1A2CYP3A4CYP2A6 | |
| SCHEMBL12854064 | 0.91 | RPS6KA3 (0.56) | RPS6KA3TNFCYP1A2CYP3A4CYP2A6 | |
| SCHEMBL526375 | 0.88 | RPS6KA3 (0.55) | RPS6KA3TNFCYP1A2CYP3A4CYP2A6 | |
| SCHEMBL28594934 | 0.88 | RPS6KA3 (0.54) | RPS6KA3TNFCYP1A2CYP3A4CYP2A6 | |
| SCHEMBL28596691 | 0.88 | RPS6KA3 (0.54) | RPS6KA3TNFCYP1A2CYP3A4CYP2A6 | |
| SCHEMBL20358436 | 0.84 | RPS6KA3 (0.67) | RPS6KA3CYP1A2CYP3A4CYP2A6CYP2E1 | |
| SCHEMBL7261854 | 0.83 | RPS6KA3 (0.50) | RPS6KA3TNFCYP1A2CYP3A4CYP2A6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5731487-A | USING A COORDINATION CATALYST | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-03-24 | — | — | US | disclosed |
| EP-0614865-B1 | Process for producing olefins having a terminal double bond | SUMITOMO CHEMICAL CO (JP) | 1997-10-15 | — | — | EP | disclosed |
| EP-0614865-A1 | Process for producing olefins having a terminal double bond | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1994-09-14 | — | — | EP | disclosed |
| CN-1014598-B | The method for preparing polychlorophosphnitrile | ATOCHEM (FR) | 1991-11-06 | — | — | CN | disclosed |