Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 3/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.31 |
| ▸ | CYP21A2 | P08686 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | PPARG | P37231 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6973130 | 0.92 | ENPP2 (0.32) | ENPP2CYP19A1MEN1KMT2ACYP17A1 | |
| SCHEMBL6975545 | 0.92 | GRIN1 (0.34) | ENPP2CYP19A1TP53PPARG | |
| SCHEMBL6967988 | 0.92 | ENPP2 (0.35) | ENPP2CYP19A1MEN1KMT2AP2RX3 | |
| SCHEMBL6957825 | 0.91 | ENPP2 (0.35) | ENPP2CYP19A1MEN1KMT2ACYP17A1 | |
| SCHEMBL7082775 | 0.90 | TLR8 (0.33) | ENPP2CYP19A1MEN1KMT2AP2RX3 | |
| SCHEMBL6972580 | 0.90 | GRIN1 (0.36) | ENPP2MEN1KMT2A | |
| SCHEMBL6965758 | 0.87 | ENPP2 (0.34) | ENPP2CYP19A1MEN1KMT2APPARG | |
| SCHEMBL8343038 | 0.86 | TBXA2R (0.42) | ENPP2MEN1KMT2A | |
| SCHEMBL6960486 | 0.86 | IDO1 (0.34) | KMT2AP2RX3TP53 | |
| SCHEMBL7085356 | 0.86 | ENPP2 (0.36) | ENPP2MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0786455-B1 | IMIDAZOLE DERIVATIVE | SHIONOGI & CO (JP) | 2003-12-03 | — | — | EP | disclosed |
| US-6147097-A | METHOD FOR TREATING AIDS | SHIONOGI & CO., LTD. (JP) | 2000-11-14 | — | — | US | disclosed |
| US-5910506-A | IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC | SHIONOGI & CO., LTD. (JP) | 1999-06-08 | — | — | US | disclosed |