Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 3/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | GID4 | Q8IVV7 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11676259 | 0.79 | ALDH1A1 (0.49) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B | |
| SCHEMBL29625707 | 0.79 | ALDH1A1 (0.49) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B | |
| SCHEMBL9988082 | 0.75 | ADRA2A (0.43) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B | |
| SCHEMBL9988032 | 0.75 | GID4 (0.41) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B | |
| SCHEMBL11442085 | 0.72 | ALDH1A1 (0.44) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B | |
| SCHEMBL9987957 | 0.72 | TAS1R3 (0.47) | MEN1KMT2AKDM4EGID4MAPK1 | |
| SCHEMBL458943 | 0.71 | ALDH1A1 (0.37) | CYP2D6ALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL8967058 | 0.71 | ADRA2A (0.47) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B | |
| SCHEMBL11409161 | 0.70 | CYP1B1 (0.39) | CYP2D6ALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL4204524 | 0.70 | ADRA1A (0.59) | ADRA2AADRA1ACYP2D6ADRA1DADRA1B |
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-8143446-B2 | Substituted acrylamide derivative and pharmaceutical composition comprising the same | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2012-03-27 | — | — | US | disclosed |