Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | DPP4 | P27487 | 7/20 | 0.53 |
| ▸ | DPP7 | Q9UHL4 | 7/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.53 |
| ▸ | CTSL | P07711 | 1/20 | 0.53 |
| ▸ | CTSB | P07858 | 1/20 | 0.53 |
| ▸ | CTSK | P43235 | 1/20 | 0.53 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.47 |
| ▸ | REN | P00797 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13580104 | 0.89 | ALDH1A1 (0.62) | ALDH1A1GAATSHRDPP4DPP7 | |
| SCHEMBL3206159 | 0.85 | ALDH1A1 (0.57) | ALDH1A1GAATSHRDPP4DPP7 | |
| SCHEMBL3206152 | 0.85 | ALDH1A1 (0.57) | ALDH1A1GAATSHRDPP4DPP7 | |
| SCHEMBL3208323 | 0.84 | ALDH1A1 (0.65) | ALDH1A1GAATSHRDPP4DPP7 | |
| SCHEMBL3208318 | 0.84 | ALDH1A1 (0.65) | ALDH1A1GAATSHRDPP4DPP7 | |
| SCHEMBL6888432 | 0.84 | ALDH1A1 (0.70) | ALDH1A1GAATSHRDPP4DPP7 | |
| SCHEMBL381922 | 0.82 | ALDH1A1 (0.85) | ALDH1A1GAATSHRDPP4DPP7 | |
| SCHEMBL3948456 | 0.82 | ALDH1A1 (0.85) | ALDH1A1GAATSHRDPP4DPP7 | |
| SCHEMBL3948461 | 0.82 | ALDH1A1 (0.85) | ALDH1A1GAATSHRDPP4DPP7 | |
| SCHEMBL29629027 | 0.81 | ALDH1A1 (0.57) | ALDH1A1GAATSHRDPP4DPP7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012101062-A1 | SUBSTITUTED BI-HETEROARYL COMPOUNDS AS CDK9 INHIBITORS AND THEIR USES | NOVARTIS AG (CH) | 2012-08-02 | — | — | WO | disclosed |
| WO-2012066065-A1 | PHENYL-HETEROARYL AMINE COMPOUNDS AND THEIR USES | NOVARTIS AG (CH) | 2012-05-24 | — | — | WO | disclosed |