Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | CRHBP | P24387 | 2/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.43 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2656910 | 0.81 | AKR1C3 (0.55) | AKR1C3AKR1C2SMN1; SMN2AKR1C1PTGS1 | |
| SCHEMBL2657051 | 0.80 | AKR1C3 (0.44) | TAS1R3TAS1R1BCHEACHEPOLB | |
| SCHEMBL2049579 | 0.75 | ALDH1A1 (0.66) | ALDH1A1CRHBPCRHR2POLBMEN1 | |
| SCHEMBL27586799 | 0.74 | SMN1; SMN2 (0.40) | ALDH1A1TAS1R3TAS1R1BCHEACHE | |
| SCHEMBL20110762 | 0.72 | RORC (0.51) | ALDH1A1CRHBPCRHR2GAASMN1; SMN2 | |
| SCHEMBL11483306 | 0.71 | SMN1; SMN2 (0.47) | ALDH1A1TAS1R3TAS1R1POLBMEN1 | |
| SCHEMBL7849220 | 0.71 | MKNK1 (0.45) | ALDH1A1MEN1KMT2ACYP3A4AKR1C3 | |
| SCHEMBL11537584 | 0.70 | PTGS1 (0.55) | ALDH1A1CRHBPCRHR2POLBMEN1 | |
| SCHEMBL8285901 | 0.69 | SMN1; SMN2 (0.35) | ALDH1A1TAS1R3TAS1R1BCHEACHE | |
| SCHEMBL23967944 | 0.69 | ALDH1A1 (0.40) | ALDH1A1CRHBPCRHR2MEN1KMT2A |
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-6320050-B1 | 2-SUBSTITUTED PHENYL-3-CYCLOALKYL SUBSTITUTED N-HETEROAROMATIC PROPIONAMIDES; USED TO INCREASE INSULIN SECRETION IN THE TREATMENT OF TYPE II DIABETES. | HOFFMANN-LA ROCHE INC. | 2001-11-20 | — | — | US | disclosed |