Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GPR183 | P32249 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 6/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10054025 | 1.00 | CYP1A2 (0.39) | CYP1A2GPR183ALDH1A1RAB9AKDM4E | |
| SCHEMBL4624190 | 0.92 | CYP1A2 (0.44) | CYP1A2GPR183ALDH1A1RAB9AKDM4E | |
| SCHEMBL801380 | 0.92 | CYP1A2 (0.44) | CYP1A2GPR183ALDH1A1RAB9AKDM4E | |
| SCHEMBL992672 | 0.92 | CYP1A2 (0.44) | CYP1A2GPR183ALDH1A1RAB9AKDM4E | |
| SCHEMBL13892093 | 0.92 | CYP1A2 (0.44) | CYP1A2ALDH1A1RAB9AKDM4EHPGD | |
| SCHEMBL10054022 | 0.86 | TSHR (0.47) | CYP1A2ALDH1A1RAB9AKDM4EMAPT | |
| SCHEMBL13045361 | 0.86 | TSHR (0.47) | CYP1A2ALDH1A1RAB9AKDM4EMAPT | |
| SCHEMBL13045369 | 0.86 | TSHR (0.47) | CYP1A2GPR183ALDH1A1RAB9AKDM4E | |
| SCHEMBL13045353 | 0.86 | TSHR (0.47) | CYP1A2GPR183ALDH1A1RAB9AKDM4E | |
| SCHEMBL15681222 | 0.83 | CYP1A2 (0.52) | CYP1A2ALDH1A1RAB9AKDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007068325-A1 | TRIARYLAMINE-ARYLVINYLENE MOIETY-CONTAINING CONJUGATED POLYMERS, THEIR PRODUCTION AND USE | MERCK PATENT GMBH (DE) | 2007-06-21 | — | — | WO | disclosed |