Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9259277 | 0.86 | RAB9A (0.61) | KMT2ANPC1RAB9AMEN1L3MBTL1 | |
| SCHEMBL9263722 | 0.77 | NPC1 (0.58) | KMT2ANPC1RAB9AMEN1MAOB | |
| SCHEMBL9254545 | 0.77 | MAOB (0.61) | KMT2ANPC1RAB9AMEN1CYP2C19 | |
| SCHEMBL9267165 | 0.77 | KMT2A (0.51) | KMT2ANPC1RAB9AKDM4ECYP1A2 | |
| SCHEMBL9258559 | 0.74 | MAOB (0.48) | KMT2ANPC1RAB9AMEN1MAOB | |
| SCHEMBL9267747 | 0.74 | MAOB (0.48) | KMT2ANPC1RAB9AMEN1MAOB | |
| SCHEMBL9160911 | 0.73 | MEN1 (0.44) | KMT2ANPC1RAB9AMEN1L3MBTL1 | |
| SCHEMBL9157877 | 0.71 | DRD3 (0.32) | MAOBMAOA | |
| SCHEMBL9159596 | 0.69 | DRD3 (0.32) | — | |
| SCHEMBL9158037 | 0.67 | KMT2A (0.41) | KMT2ANPC1RAB9AMAOBALDH1A1 |
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-5424320-A | Antihistamine, antiallergic, antiinflammatory and cytoprotective agents | MERCK FROSST CANADA, INC. (CA) | 1995-06-13 | — | — | US | disclosed |