Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PARG | Q86W56 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8626635 | 0.85 | ALDH1A1 (0.39) | ALDH1A1HPGDHTR1ADRD2HTR7 | |
| SCHEMBL8625727 | 0.82 | F10 (0.43) | KCNH2ALDH1A1ROCK2ROCK1PARG | |
| SCHEMBL8625631 | 0.82 | KCNH2 (0.43) | KCNH2HTR1ADRD2 | |
| SCHEMBL8625177 | 0.81 | F10 (0.44) | KCNH2HTR7HTR6 | |
| SCHEMBL2326821 | 0.81 | F10 (0.51) | ALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL8623066 | 0.81 | F10 (0.56) | KCNH2 | |
| SCHEMBL8625528 | 0.80 | F10 (0.56) | KCNH2ALDH1A1 | |
| SCHEMBL8629049 | 0.79 | ROCK2 (0.39) | KCNH2ALDH1A1SMN1; SMN2POLBROCK2 | |
| SCHEMBL8423957 | 0.78 | DRD4 (0.42) | KCNH2ALDH1A1DRD2POLBROCK2 | |
| SCHEMBL8622748 | 0.78 | F10 (0.43) | KCNH2ROCK2ROCK1 |
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-5731315-A | Substituted sulfonic acid n- (aminoiminomethyl)phenylalkyl!-azaheterocyclamide compounds | RHONE-POULENC RORER PHARMACEUTICALS INC. (US) | 1998-03-24 | — | — | US | disclosed |