Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.57 |
| ▸ | TDO2 | P48775 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | MAOA | P21397 | 1/20 | 0.55 |
| ▸ | MAOB | P27338 | 1/20 | 0.55 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.55 |
| ▸ | FER | P16591 | 1/20 | 0.55 |
| ▸ | LTK | P29376 | 1/20 | 0.55 |
| ▸ | CDK8 | P49336 | 1/20 | 0.55 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.55 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.55 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | TGM2 | P21980 | 1/20 | 0.54 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL30681308 | 1.00 | IDO1 (0.57) | IDO1TDO2TDP1MAOAMAOB | |
| SCHEMBL12220595 | 0.85 | ACVR1 (0.50) | IDO1TDO2TDP1MAOAMAOB | |
| SCHEMBL10399820 | 0.82 | ALDH1A1 (0.53) | IDO1TDO2TDP1MAOAMAOB | |
| SCHEMBL1465398 | 0.82 | TDP1 (0.54) | IDO1TDO2TDP1MAOAMAOB | |
| SCHEMBL1466156 | 0.82 | TDP1 (0.54) | IDO1TDO2TDP1MAOAMAOB | |
| SCHEMBL10399821 | 0.82 | ALDH1A1 (0.53) | IDO1TDO2TDP1MAOAMAOB | |
| SCHEMBL11980231 | 0.80 | IDO1 (0.61) | IDO1TDO2TDP1MAOAMAOB | |
| SCHEMBL14320160 | 0.79 | IDO1 (0.56) | IDO1TDO2TDP1MAOAMAOB | |
| SCHEMBL4165371 | 0.79 | IDO1 (0.56) | IDO1TDO2TDP1MAOAMAOB | |
| SCHEMBL4165379 | 0.79 | IDO1 (0.56) | IDO1TDO2TDP1MAOAMAOB |
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 |