Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 5/20 | 0.59 |
| ▸ | PRKACA | P17612 | 5/20 | 0.59 |
| ▸ | PRKACG | P22612 | 5/20 | 0.59 |
| ▸ | PRKACB | P22694 | 5/20 | 0.59 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
| ▸ | TUBB | P07437 | 1/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7984223 | 0.91 | SRC (0.59) | SRCPRKACAPRKACGPRKACBMAPK7 | |
| SCHEMBL7983591 | 0.84 | SRC (0.60) | SRCPRKACAPRKACGPRKACB | |
| SCHEMBL7970110 | 0.82 | SRC (0.38) | SRCPRKACAPRKACGPRKACBCYP1A2 | |
| SCHEMBL7981595 | 0.74 | SRC (0.55) | SRCPRKACAPRKACGPRKACBMAPK7 | |
| SCHEMBL7980197 | 0.74 | SRC (1.00) | SRCPRKACAPRKACGPRKACB | |
| SCHEMBL7983594 | 0.74 | EED (0.41) | SRCPRKACAPRKACGPRKACBTUBB4A | |
| SCHEMBL7971057 | 0.73 | SRC (0.52) | SRCPRKACAPRKACGPRKACB | |
| SCHEMBL7984590 | 0.68 | PRKDC (0.36) | CYP3A4KDRTUBB1 | |
| SCHEMBL7987262 | 0.68 | SRC (0.50) | SRCPRKACAPRKACGPRKACBCYP1A2 | |
| SCHEMBL5560537 | 0.67 | AKR1C3 (0.47) | SRCPRKACAPRKACGPRKACBAKR1C3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6271423-B1 | REACTING BUTADIENE WITH ALCOHOLS IN THE PRESENCE OF TRANSITION METAL COMPLEXES CONTAINING METALLOCENE LIGANDS | BASF AKTIENGESELLSCHAFT (DE) | 2001-08-07 | — | — | US | disclosed |
| EP-0586608-A1 | TRICYCLIC POLYHYDROXYLIC TYROSINE KINASE INHIBITORS | PFIZER INC. (US) | 1994-03-16 | — | — | EP | disclosed |