Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.87 |
| ▸ | BCR | P11274 | 1/20 | 0.87 |
| ▸ | TEK | Q02763 | 6/20 | 0.64 |
| ▸ | LCK | P06239 | 5/20 | 0.64 |
| ▸ | KDR | P35968 | 5/20 | 0.64 |
| ▸ | KIT | P10721 | 11/20 | 0.45 |
| ▸ | DDR1 | Q08345 | 10/20 | 0.45 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
| ▸ | DDR2 | Q16832 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15363823 | 0.93 | ABL1 (0.80) | ABL1BCRTEKLCKKDR | |
| Vodobatinib SCHEMBL29441271 | 0.93 | ABL1 (1.00) | ABL1BCRTEKLCKKDR | |
| SCHEMBL18274640 | 0.93 | ABL1 (0.80) | ABL1BCRTEKLCKKDR | |
| SCHEMBL11300093 | 0.93 | ABL1 (0.80) | ABL1BCRTEKLCKKDR | |
| Vodobatinib SCHEMBL29386210 | 0.93 | ABL1 (1.00) | ABL1BCRTEKLCKKDR | |
| Vodobatinib SCHEMBL15363815 | 0.93 | ABL1 (1.00) | ABL1BCRTEKLCKKDR | |
| SCHEMBL18274633 | 0.93 | ABL1 (0.76) | ABL1BCRTEKLCKKDR | |
| SCHEMBL15363783 | 0.92 | ABL1 (0.77) | ABL1BCRTEKLCKKDR | |
| SCHEMBL15364084 | 0.91 | ABL1 (0.93) | ABL1BCRTEKLCKKDR | |
| SCHEMBL15363890 | 0.91 | ABL1 (0.75) | ABL1BCRTEKLCKKDR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2665709-B1 | DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS | SUN PHARMA ADVANCED RES CO LTD (IN) | 2016-12-07 | — | — | EP | disclosed |
| EP-2665709-A1 | DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS | Sun Pharma Advanced Research Company Limited (IN) | 2013-11-27 | — | — | EP | disclosed |
| WO-2012098416-A1 | DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS | SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) | 2012-07-26 | — | — | WO | disclosed |