Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 2/20 | 0.51 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.51 |
| ▸ | DRD1 | P21728 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
| ▸ | CCKBR | P32239 | 1/20 | 0.51 |
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 SCHEMBL7412175 | 0.87 | ABCB11 (0.53) | MEN1KMT2AKDM4EALDH1A1HTR2A | |
| Hydrochloric Acid SCHEMBL7412168 | 0.87 | ABCB11 (0.53) | MEN1KMT2AKDM4EALDH1A1HTR2A | |
| SCHEMBL10556891 | 0.85 | ABCB11 (0.57) | MEN1KMT2AKDM4EALDH1A1HTR2A | |
| Oxalic Acid SCHEMBL10459168 | 0.83 | ALDH1A1 (0.59) | MEN1KMT2AKDM4EALDH1A1HTR2A | |
| SCHEMBL7320146 | 0.83 | ABCB11 (0.61) | MEN1KMT2AKDM4EALDH1A1HTR2A | |
| Oxalic Acid SCHEMBL10460873 | 0.82 | ABCB11 (0.58) | MEN1KMT2AKDM4EALDH1A1HTR2A | |
| SCHEMBL10461124 | 0.81 | ABCB11 (0.59) | MEN1KMT2AKDM4EALDH1A1HTR2A | |
| SCHEMBL10557011 | 0.80 | ABCB11 (0.57) | MEN1KMT2AKDM4EALDH1A1HTR2A | |
| Fumaric Acid SCHEMBL10559636 | 0.80 | ABCB11 (0.56) | MEN1KMT2AKDM4EALDH1A1HTR2A | |
| Fumaric Acid SCHEMBL10559646 | 0.80 | ABCB11 (0.56) | MEN1KMT2AKDM4EALDH1A1HTR2A |
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-5198449-A | N-substituted alpha-arylazacycloalkylmethanamines and their use as cardiovascular agents | A. H. ROBINS COMPANY INCORPORATED (US) | 1993-03-30 | — | — | US | disclosed |