Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.40 |
| ▸ | MMP1 | P03956 | 2/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.38 |
| ▸ | MMP9 | P14780 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9016505 | 0.86 | PPARG (0.41) | NPC1MAPTRAB9AKMT2APOLB | |
| SCHEMBL9016500 | 0.86 | PPARG (0.41) | NPC1MAPTRAB9AKMT2APOLB | |
| SCHEMBL9016461 | 0.77 | PPARG (0.36) | CYP3A4NPC1KMT2APOLB | |
| SCHEMBL9016513 | 0.74 | ADAMTS4 (0.37) | MEN1NPC1KMT2APOLB | |
| SCHEMBL9016432 | 0.72 | MEN1 (0.44) | CYP3A4MEN1NPC1MAPTRAB9A | |
| SCHEMBL9016533 | 0.72 | MEN1 (0.46) | MEN1NPC1MAPTRAB9AKMT2A | |
| SCHEMBL9559199 | 0.72 | CYP1A2 (0.56) | CYP3A4ESR1ESR2HIF1ACHRNB4 | |
| SCHEMBL927004 | 0.71 | CYP3A4 (0.53) | CYP3A4ESR1ESR2CHRNB4CHRNA3 | |
| SCHEMBL30398332 | 0.67 | CYP3A4 (0.62) | CYP3A4ESR1ESR2CHRNB4CHRNA3 | |
| SCHEMBL16902843 | 0.67 | CYP3A4 (0.57) | CYP3A4ESR1ESR2CHRNB4CHRNA3 |
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-5574153-A | BACTERICIDES | ACS DOBFAR S.P.A. (IT) | 1996-11-12 | — | — | US | disclosed |
| EP-0638574-A1 | Oxime derivatives of cephalosporanic structure and compounds for their preparation | ACS DOBFAR S.p.A. (IT) | 1995-02-15 | — | — | EP | disclosed |