Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | KLK7 | P49862 | 6/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.40 |
| ▸ | RORC | P51449 | 3/20 | 0.40 |
| ▸ | RXRA | P19793 | 2/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.40 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | KLK5 | Q9Y337 | 5/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8952612 | 1.00 | ABCB1 (0.47) | ABCB1ELANEKLK7NR1H2RORC | |
| SCHEMBL8952629 | 1.00 | ABCB1 (0.47) | ABCB1ELANEKLK7NR1H2RORC | |
| SCHEMBL8952619 | 1.00 | ABCB1 (0.47) | ABCB1ELANEKLK7NR1H2RORC | |
| SCHEMBL4961152 | 0.86 | ABCB1 (0.43) | ABCB1ELANEKLK7NR1H2RORC | |
| SCHEMBL9924398 | 0.83 | ELANE (0.44) | ABCB1ELANEKLK7NR1H2RORC | |
| SCHEMBL14050230 | 0.83 | ELANE (0.44) | ABCB1ELANEKLK7NR1H2RORC | |
| SCHEMBL16237822 | 0.83 | ELANE (0.44) | ABCB1ELANEKLK7NR1H2RORC | |
| SCHEMBL14199221 | 0.83 | ELANE (0.44) | ABCB1ELANEKLK7NR1H2RORC | |
| SCHEMBL5963534 | 0.83 | ELANE (0.44) | ABCB1ELANEKLK7NR1H2RORC | |
| SCHEMBL7967355 | 0.81 | ELANE (0.53) | ABCB1ELANEKLK7NR1H2RORC |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0690856-B1 | ANTI-TUMOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, METHODS FOR PREPARATION THEREOF AND FOR TREATMENT | UNIV NEW YORK STATE RES FOUND (US) | 2002-12-04 | — | — | EP | disclosed |
| US-5705508-A | FORMING TAXOL DERIVATIVES | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1998-01-06 | — | — | US | disclosed |
| US-5599820-A | Anti-tumor compounds, pharmaceutical compositions, methods for preparation thereof and for treatment | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1997-02-04 | — | — | US | disclosed |
| US-5475011-A | Anti-tumor compounds, pharmaceutical compositions, methods for preparation thereof and for treatment | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1995-12-12 | — | — | US | disclosed |