Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL9016539 | 0.81 | CYP1A2 (0.46) | CYP1A2KMT2ACYP2D6SRCLMNA | |
| SCHEMBL18901910 | 0.79 | CYP1A2 (0.45) | CYP1A2KMT2ACYP2D6SRCLMNA | |
| SCHEMBL9016492 | 0.77 | CYP1A2 (0.53) | CYP1A2CYP2D6SRCLMNAALDH1A1 | |
| SCHEMBL12756966 | 0.73 | KMT2A (0.41) | KMT2AALDH1A1MAPTGAAPOLB | |
| SCHEMBL27556320 | 0.72 | CYP1A2 (0.57) | CYP1A2KMT2ACYP2D6SRCLMNA | |
| SCHEMBL18526631 | 0.72 | CYP1A2 (0.45) | CYP1A2KMT2ACYP2D6SRCLMNA | |
| SCHEMBL9016505 | 0.72 | PPARG (0.41) | CYP1A2KMT2ALMNAALDH1A1MAPK1 | |
| SCHEMBL9016500 | 0.72 | PPARG (0.41) | CYP1A2KMT2ALMNAALDH1A1MAPK1 | |
| SCHEMBL25404016 | 0.72 | CYP1A2 (0.61) | CYP1A2KMT2ACYP2D6SRCLMNA | |
| SCHEMBL7500324 | 0.72 | DPP4 (0.39) | KMT2ALMNAALDH1A1 |
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 |