Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 6/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | XIAP | P98170 | 3/20 | 0.33 |
| ▸ | ELANE | P08246 | 2/20 | 0.33 |
| ▸ | BIRC3 | Q13489 | 2/20 | 0.32 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7314868 | 1.00 | MCL1 (0.37) | MCL1CTSSCTSKXIAPELANE | |
| SCHEMBL7314881 | 1.00 | MCL1 (0.37) | MCL1CTSSCTSKXIAPELANE | |
| SCHEMBL7305041 | 0.80 | XIAP (0.38) | CTSSCTSKXIAPBIRC3BIRC2 | |
| SCHEMBL7305036 | 0.80 | XIAP (0.38) | CTSSCTSKXIAPBIRC3BIRC2 | |
| SCHEMBL7317417 | 0.80 | XIAP (0.38) | CTSSCTSKXIAPBIRC3BIRC2 | |
| SCHEMBL7308390 | 0.75 | TACR1 (0.44) | XIAPBIRC3BIRC2TACR1 | |
| SCHEMBL8083547 | 0.75 | TACR1 (0.44) | XIAPBIRC3BIRC2TACR1 | |
| SCHEMBL7314874 | 0.74 | MAPT (0.33) | MEN1KMT2A | |
| SCHEMBL7318701 | 0.74 | DPP4 (0.44) | — | |
| SCHEMBL7318694 | 0.74 | DPP4 (0.44) | — |
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-1041064-A2 | N-substituted alpha aminoacid amides as calcium channel modulators | ELI LILLY AND COMPANY LIMITED (GB) | 2000-10-04 | — | — | EP | disclosed |
| EP-0805147-A1 | Novel N-substituted alpha aminoacid amides as calcium channel modulators | LILLY INDUSTRIES LIMITED (GB) | 1997-11-05 | — | — | EP | disclosed |