Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 7/20 | 0.38 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1416213 | 0.80 | LOXL2 (0.54) | LOXL2RECQLHSD17B10KCNQ2CA2 | |
| SCHEMBL4250874 | 0.78 | RECQL (0.59) | LOXL2RECQLCA2ENPP1NPC1 | |
| SCHEMBL4245616 | 0.76 | CHRNA7 (0.58) | RECQL | |
| SCHEMBL3822630 | 0.73 | — | — | |
| SCHEMBL24669612 | 0.70 | RECQL (0.50) | RECQLCA2ENPP1CA1CA5A | |
| SCHEMBL4252626 | 0.69 | RECQL (0.48) | RECQLCA2ENPP1NPC1KMT2A | |
| SCHEMBL17184443 | 0.69 | LOXL2 (0.61) | LOXL2HSD17B10KCNQ2 | |
| SCHEMBL4940553 | 0.69 | LOXL2 (0.50) | LOXL2RECQLHSD17B10KCNQ2HCAR2 | |
| SCHEMBL358612 | 0.69 | — | — | |
| SCHEMBL19346087 | 0.69 | — | — |
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-2049494-A2 | TYROSINE KINASE INHIBITORS | Merck & Co., Inc. (US) | 2009-04-22 | — | — | EP | claimed |
| WO-2008008310-A2 | TYROSINE KINASE INHIBITORS | MERCK & CO., INC. (US) | 2008-01-17 | — | — | WO | claimed |
| EP-2049494-A2 | TYROSINE KINASE INHIBITORS | Merck & Co., Inc. (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008008310-A2 | TYROSINE KINASE INHIBITORS | MERCK & CO., INC. (US) | 2008-01-17 | — | — | WO | disclosed |