Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 5/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | AR | P10275 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | DHODH | Q02127 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL234452 | 0.87 | ACHE (0.47) | RAB9ADHODHKDM4EALDH1A1MAPT | |
| SCHEMBL29133411 | 0.84 | DHODH (0.46) | NPC1RAB9AARDHODHKDM4E | |
| SCHEMBL4875167 | 0.82 | MAPT (0.46) | NPC1RAB9AKDM4EALDH1A1MAPT | |
| SCHEMBL8087285 | 0.81 | CYP19A1 (0.47) | CYP2C9CYP3A4NPC1RAB9ACYP1A2 | |
| SCHEMBL4907021 | 0.81 | NPC1 (0.53) | NPC1RAB9ACYP1A2KDM4EMAPT | |
| SCHEMBL5780643 | 0.81 | CYP19A1 (0.47) | NPC1RAB9ADHODHKDM4EALDH1A1 | |
| SCHEMBL4912670 | 0.81 | ALDH1A1 (0.45) | CYP3A4NPC1RAB9ACYP1A2KDM4E | |
| SCHEMBL4901955 | 0.81 | CYP1A1 (0.41) | NPC1RAB9ACYP1A2KDM4EALDH1A1 | |
| SCHEMBL8096265 | 0.79 | PDGFRB (0.44) | CYP2C9CYP3A4NPC1ARCYP2C19 | |
| SCHEMBL4909955 | 0.77 | KDM4E (0.58) | NPC1RAB9AKDM4EALDH1A1MAPT |
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-6063956-A | APPLYING FUNGICIDE OR INSECTICIDE TO THE LOCUS WHERE CONTROL IS DESIRED | ROHM AND HAAS COMPANY (US) | 2000-05-16 | — | — | US | disclosed |