Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 2/20 | 0.44 |
| ▸ | KDR | P35968 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8809261 | 0.88 | BCHE (0.45) | SMPD1CYP3A4CYP2C9KDM4EMEN1 | |
| SCHEMBL8809264 | 0.83 | ABCG2 (0.41) | SMPD1CYP3A4MAPTTP53TSHR | |
| SCHEMBL8807068 | 0.77 | KCNH2 (0.44) | KDRCYP3A4CYP2C19CYP2C8CYP2C9 | |
| SCHEMBL8789872 | 0.77 | ABCG2 (0.57) | KDRCYP3A4CYP2C19CYP2C8CYP2C9 | |
| SCHEMBL8790216 | 0.76 | ABCG2 (0.62) | SMPD1KDRCYP3A4CYP2C19CYP2C8 | |
| SCHEMBL8808718 | 0.76 | MAPT (0.48) | KDRCYP3A4CYP2C19KCNH2MAPT | |
| SCHEMBL8808236 | 0.75 | MAPT (0.45) | SMPD1KDRCYP3A4CYP2C19CYP2C8 | |
| SCHEMBL8789875 | 0.75 | SMPD1 (0.45) | SMPD1KDRKCNH2MAPTTP53 | |
| SCHEMBL8808344 | 0.74 | ACHE (0.49) | KDRCYP3A4CYP2C19MAPTTP53 | |
| SCHEMBL7168892 | 0.74 | CYP3A4 (0.55) | SMPD1CYP3A4CYP2C19CYP2C8CYP2C9 |
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-5663179-A | CAN SENSITIZE MULTIDRUG RESISTANT CANCER CELLS TO CHEMOTHERAPEUTIC AGENTS | LABORATOIRES GLAXO SA (FR) | 1997-09-02 | — | — | US | disclosed |
| EP-0649410-B1 | ANILIDE DERIVATIVES | GLAXO LAB SA (FR) | 1997-05-02 | — | — | EP | disclosed |