Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | SLC1A5 | Q15758 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7316978 | 0.80 | KEAP1 (0.50) | TACR1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8083648 | 0.76 | L3MBTL1 (0.40) | CTSL | |
| SCHEMBL7313523 | 0.74 | CTSK (0.43) | CTSKMAPTCTSL | |
| SCHEMBL7314045 | 0.74 | CTSK (0.43) | CTSKMAPTCTSL | |
| SCHEMBL7265609 | 0.69 | L3MBTL1 (0.46) | MAPTSLC1A5 | |
| SCHEMBL29280233 | 0.68 | TPSAB1 (0.43) | CTSKCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7993210 | 0.68 | TPSAB1 (0.43) | CTSKCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8297502 | 0.68 | TPSAB1 (0.43) | CTSKCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7104697 | 0.68 | ALDH1A1 (0.40) | CTSKCYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL16869921 | 0.68 | CCKBR (0.53) | MAPTCTSL |
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 |