Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AXL | P30530 | 4/20 | 0.46 |
| ▸ | LDHA | P00338 | 1/20 | 0.44 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | CAMKK2 | Q96RR4 | 3/20 | 0.43 |
| ▸ | GSK3A | P49840 | 3/20 | 0.42 |
| ▸ | GSK3B | P49841 | 3/20 | 0.42 |
| ▸ | PRKCI | P41743 | 1/20 | 0.42 |
| ▸ | PIK3C3 | Q8NEB9 | 2/20 | 0.41 |
| ▸ | SGK1 | O00141 | 3/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2322786 | 0.86 | LDHA (0.54) | AXLLDHAPARP1CAMKK2PRKCI | |
| Hydrochloric Acid SCHEMBL3528772 | 0.85 | LDHA (0.53) | AXLLDHAPARP1CAMKK2PRKCI | |
| SCHEMBL10203111 | 0.83 | LDHA (0.44) | AXLLDHAPSMB5PARP1CAMKK2 | |
| SCHEMBL7093171 | 0.81 | AXL (0.60) | AXLCAMKK2PRKCISGK1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7093169 | 0.80 | AXL (0.59) | AXLCAMKK2PRKCISGK1ALDH1A1 | |
| SCHEMBL4768072 | 0.79 | PSMB5 (0.42) | AXLLDHAPSMB5PARP1CAMKK2 | |
| SCHEMBL12024784 | 0.77 | NPC1 (0.49) | GSK3AGSK3BPRKCIPIK3C3ALDH1A1 | |
| SCHEMBL2325653 | 0.75 | PARP1 (0.40) | AXLLDHAPSMB5PARP1CAMKK2 | |
| SCHEMBL2325767 | 0.75 | MAOA (0.42) | AXLLDHAPSMB5PARP1MAP4K4 | |
| SCHEMBL12024779 | 0.75 | HPGDS (0.55) | AXLMAP4K4CHEK2ALDH1A1 |
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-1896421-A2 | BENZOCYCLOHEPTAPYRIDINES AS INHIBITORS OF THE RECEPTOR TYROSINE KINASE MET | Merck & Co., Inc. (US) | 2008-03-12 | — | — | EP | disclosed |
| WO-2007002254-A2 | BENZOCYCLOHEPTAPYRIDINES AS INHIBITORS OF THE RECEPTOR TYROSINE KINASE MET | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | disclosed |