Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.50 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.46 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | KIT | P10721 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL9044161 | 0.92 | ALDH1A1 (0.47) | ROCK1PDGFRBPDGFRAALDH1A1LMNA | |
| SCHEMBL8650527 | 0.78 | EGFR (0.67) | ROCK1PDGFRBPDGFRAACHEBACE1 | |
| SCHEMBL5243650 | 0.78 | ROCK1 (0.45) | ROCK1PDGFRBPDGFRAALDH1A1LMNA | |
| SCHEMBL14214527 | 0.74 | PTK2 (0.59) | ROCK1PDGFRBPDGFRACSF1R | |
| SCHEMBL9115700 | 0.74 | EGFR (0.61) | ROCK1PDGFRBPDGFRAACHEBACE1 | |
| SCHEMBL27479086 | 0.73 | CYP1A2 (0.46) | ROCK1ALDH1A1LMNAMAPTHTT | |
| SCHEMBL5751751 | 0.72 | ROCK1 (0.46) | ROCK1ALDH1A1MAPTHTTSMN1; SMN2 | |
| SCHEMBL5756449 | 0.72 | MAPT (0.49) | ROCK1ALDH1A1LMNAMAPTHTT | |
| SCHEMBL8266278 | 0.70 | ROCK1 (0.40) | ROCK1ALDH1A1LMNAMAPTHTT | |
| SCHEMBL5755108 | 0.69 | MAPT (0.54) | ALDH1A1LMNAMAPTHTTMAPK1 |
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-5736534-A | HYPERPROLIFERATIVE DISEASES; INHIBITORS OF PROTEIN-TYROSINE KINASES SUCH AS EPIDERMAL GROWTH FACTOR RECEPTOR; BRAIN, LUNG, BREAST CANCER; PSORIASIS AND BENIGN PROSTATE HYPERPLASIA | PFIZER INC. (US) | 1998-04-07 | — | — | US | disclosed |