Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPA1 | P27694 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.58 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.58 |
| ▸ | FABP3 | P05413 | 1/20 | 0.56 |
| ▸ | FABP4 | P15090 | 1/20 | 0.56 |
| ▸ | EGFR | P00533 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.52 |
| ▸ | CDK1 | P06493 | 1/20 | 0.52 |
| ▸ | CDK4 | P11802 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6457787 | 0.98 | ALDH1A1 (0.60) | RPA1ALDH1A1LMNAHTTPTGS2 | |
| SCHEMBL11391264 | 0.95 | RPA1 (0.67) | RPA1ALDH1A1LMNAHTTPTGS2 | |
| SCHEMBL15452759 | 0.92 | PTGS2 (0.69) | RPA1ALDH1A1LMNAHTTPTGS2 | |
| SCHEMBL5214995 | 0.91 | PTGS2 (0.67) | RPA1PTGS2PTGS1FABP3FABP4 | |
| SCHEMBL13029788 | 0.88 | RAB9A (0.53) | RPA1ALDH1A1PTGS1FABP3FABP4 | |
| SCHEMBL3852411 | 0.87 | RAB9A (0.62) | RPA1ALDH1A1LMNAHTTPTGS1 | |
| SCHEMBL3857283 | 0.86 | RAB9A (0.61) | RPA1ALDH1A1LMNAHTTPTGS1 | |
| SCHEMBL1198398 | 0.86 | RAB9A (0.65) | RPA1ALDH1A1LMNAHTTPTGS1 | |
| SCHEMBL18826381 | 0.85 | PTGS2 (0.82) | PTGS2PTGS1CYP2C9 | |
| SCHEMBL8291470 | 0.84 | PTGS2 (0.68) | RPA1ALDH1A1LMNAPTGS2PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109890822-A | INHIBITORS OF CELLULAR METABOLIC PROCESSES | 安吉奥斯医药品有限公司 | 2019-06-14 | — | — | CN | disclosed |