Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 13/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3076852 | 0.90 | NTRK1 (0.62) | NTRK1ALDH1A1MEN1KMT2A | |
| SCHEMBL7834403 | 0.81 | NTRK1 (0.65) | NTRK1ALDH1A1L3MBTL1 | |
| SCHEMBL7543844 | 0.72 | NTRK1 (0.47) | NTRK1POLBSMN1; SMN2 | |
| SCHEMBL3094061 | 0.72 | NTRK1 (0.80) | NTRK1 | |
| SCHEMBL16866541 | 0.67 | ALDH1A1 (0.55) | POLBALDH1A1SMN1; SMN2RECQLMEN1 | |
| SCHEMBL10481226 | 0.67 | KMT2A (0.65) | POLBTDP1ALDH1A1SMN1; SMN2RECQL | |
| SCHEMBL7833961 | 0.66 | NTRK1 (0.48) | NTRK1ALDH1A1L3MBTL1 | |
| SCHEMBL3087437 | 0.65 | NTRK1 (0.65) | NTRK1 | |
| SCHEMBL3089722 | 0.65 | NTRK1 (0.67) | NTRK1 | |
| SCHEMBL3079365 | 0.63 | NTRK1 (0.63) | NTRK1ALDH1A1SMN1; SMN2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1084114-A1 | ISOTHIAZOLE DERIVATIVES USEFUL AS ANTICANCER AGENTS | Pfizer Products Inc. (US) | 2001-03-21 | — | — | EP | disclosed |
| WO-1999062890-A1 | ISOTHIAZOLE DERIVATIVES USEFUL AS ANTICANCER AGENTS | PFIZER PRODUCTS INC. (US) | 1999-12-09 | — | — | WO | disclosed |