Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.54 |
| ▸ | MAOB | P27338 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | MMP12 | P39900 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | PDE5A | O76074 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9550442 | 0.85 | MAOA (0.51) | MAOAMAOBNPC1RAB9ACYP19A1 | |
| SCHEMBL8677842 | 0.83 | MAOA (0.58) | MAOAMAOBNPC1RAB9ACYP19A1 | |
| Mitoflaxone SCHEMBL106705 | 0.81 | CYP1A2 (0.62) | MAOAMAOBNPC1RAB9ATDP1 | |
| SCHEMBL9550408 | 0.80 | MAOB (0.58) | MAOAMAOBNPC1RAB9ACYP19A1 | |
| SCHEMBL10573839 | 0.80 | MAOB (0.58) | MAOAMAOBNPC1RAB9ACYP19A1 | |
| SCHEMBL5123575 | 0.80 | MAOB (0.58) | MAOAMAOBNPC1RAB9ACYP19A1 | |
| SCHEMBL12835503 | 0.79 | CYP1A2 (0.60) | MAOAMAOBNPC1RAB9ATDP1 | |
| SCHEMBL9369582 | 0.78 | PTGES (0.45) | NPC1RAB9APTGESTP53ABCB1 | |
| SCHEMBL23218567 | 0.76 | CFD (0.68) | PTGER1 | |
| SCHEMBL8155546 | 0.76 | MAOA (0.58) | MAOAMAOBNPC1RAB9ACYP19A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5182295-A | Miticides, fungicides | ROUSSEL UCLAF (FR) | 1993-01-26 | — | — | US | disclosed |