Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.34 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27976224 | 0.89 | ALDH1A1 (0.49) | ALDH1A1TSHRHTTMAPTKMT2A | |
| SCHEMBL9091617 | 0.84 | ALDH1A1 (0.45) | ALDH1A1TSHRHTTMAPTKMT2A | |
| SCHEMBL7316634 | 0.78 | ALDH1A1 (0.39) | ALDH1A1TSHRHTTKMT2AMEN1 | |
| SCHEMBL6492778 | 0.76 | CYP2C19 (0.44) | ALDH1A1KMT2AMEN1SMN1; SMN2CYP2C19 | |
| SCHEMBL6492775 | 0.76 | CYP2C19 (0.44) | ALDH1A1KMT2AMEN1SMN1; SMN2CYP2C19 | |
| SCHEMBL12238644 | 0.76 | CYP2C19 (0.44) | ALDH1A1KMT2AMEN1CYP2C19CYP2D6 | |
| SCHEMBL335125 | 0.75 | ALDH1A1 (0.53) | ALDH1A1TSHRHTTMAPTKMT2A | |
| SCHEMBL12197702 | 0.75 | MEN1 (0.48) | ALDH1A1KMT2AMEN1SMN1; SMN2CYP2C19 | |
| SCHEMBL15242554 | 0.75 | ALDH1A1 (0.53) | ALDH1A1TSHRHTTMAPTKMT2A | |
| SCHEMBL1985443 | 0.74 | ALDH1A1 (0.57) | ALDH1A1TSHRHTTMAPTKMT2A |
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 3 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 |
| US-4002179-A | Smoking compositions incorporating a menthol-release agent | PHILIP MORRIS INCORPORATED (US) | 1977-01-11 | — | — | US | disclosed |