Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | MRGPRX4 | Q96LA9 | 6/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8590603 | 0.88 | MRGPRX4 (0.57) | NPC1RAB9AMEN1KMT2AMRGPRX4 | |
| SCHEMBL8593075 | 0.86 | MAPT (0.44) | NPC1RAB9AMEN1CYP1A2CYP2C19 | |
| SCHEMBL8592229 | 0.83 | NPC1 (0.51) | NPC1RAB9AMEN1KMT2AMRGPRX4 | |
| SCHEMBL8597491 | 0.78 | FFAR1 (0.45) | NPC1RAB9ACYP1A2CYP2C19SLC6A4 | |
| SCHEMBL8596853 | 0.78 | DHFR (0.47) | NPC1RAB9AKMT2AMAPTSMN1; SMN2 | |
| SCHEMBL8592157 | 0.77 | MAPT (0.48) | NPC1RAB9AMEN1CYP1A2CYP2C19 | |
| SCHEMBL8590449 | 0.75 | MRGPRX4 (0.49) | NPC1RAB9AMEN1CYP1A2CYP2C19 | |
| SCHEMBL8590455 | 0.75 | MRGPRX4 (0.49) | NPC1RAB9AMEN1CYP1A2CYP2C19 | |
| SCHEMBL8592349 | 0.74 | MAOB (0.44) | NPC1RAB9ACYP1A2CYP2C19SLC6A4 | |
| SCHEMBL8590581 | 0.74 | MAPT (0.45) | NPC1RAB9AMEN1KMT2AMRGPRX4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0658543-B1 | PROCESS FOR PRODUCING ALPHA-ALKOXYIMINOPHENYLACETONITRILE DERIVATIVE | SHIONOGI & CO (JP) | 1998-01-07 | — | — | EP | disclosed |
| EP-0658543-A1 | PROCESS FOR PRODUCING $g(a)-ALKOXYIMINOPHENYLACETONITRILE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 1995-06-21 | — | — | EP | disclosed |