Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 8/20 | 0.61 |
| ▸ | HTR2A | P28223 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.45 |
| ▸ | DRD2 | P14416 | 2/20 | 0.45 |
| ▸ | DRD1 | P21728 | 2/20 | 0.45 |
| ▸ | DRD4 | P21917 | 2/20 | 0.45 |
| ▸ | DRD5 | P21918 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | DRD3 | P35462 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | APEX1 | P27695 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6563371 | 0.84 | KDM4E (0.58) | TAAR1HTR2AKDM4EMAPTALDH1A1 | |
| SCHEMBL29120351 | 0.82 | TAAR1 (0.52) | TAAR1HTR2AKDM4EMAPTALDH1A1 | |
| SCHEMBL27558952 | 0.81 | CYP2A6 (0.48) | TAAR1HTR2AKDM4EMAPTALDH1A1 | |
| SCHEMBL19439534 | 0.79 | CYP2A6 (0.52) | TAAR1KDM4EMAPTALDH1A1MEN1 | |
| SCHEMBL15351777 | 0.79 | CYP2A6 (0.46) | TAAR1HTR2AKDM4EMAPTALDH1A1 | |
| SCHEMBL16414929 | 0.79 | CYP2A6 (0.46) | TAAR1HTR2AKDM4EMAPTALDH1A1 | |
| SCHEMBL1639508 | 0.79 | KDM4E (0.47) | TAAR1HTR2AKDM4EMAPTALDH1A1 | |
| SCHEMBL29860016 | 0.78 | MC4R (0.58) | TAAR1HTR2AKDM4EMAPTALDH1A1 | |
| SCHEMBL38430 | 0.78 | MC4R (0.58) | TAAR1HTR2AKDM4EMAPTALDH1A1 | |
| SCHEMBL21451427 | 0.78 | MAOB (0.49) | TAAR1KDM4EMAPTALDH1A1ADRA2A |
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-2010127208-A1 | INHIBITORS OF ACETYL-COA CARBOXYLASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-11-04 | — | — | WO | disclosed |