Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | KYNU | Q16719 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CTSL | P07711 | 2/20 | 0.47 |
| ▸ | CTSB | P07858 | 2/20 | 0.47 |
| ▸ | CTSS | P25774 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL22811132 | 1.00 | MAPK1 (0.52) | MAPK1CYP3A4ALDH1A1KYNUTSHR | |
| SCHEMBL9491221 | 0.90 | ATM (0.59) | CYP3A4ALDH1A1TSHRALOX15THRB | |
| SCHEMBL330432 | 0.90 | ATM (0.59) | CYP3A4ALDH1A1TSHRALOX15THRB | |
| SCHEMBL8932361 | 0.89 | MAPK1 (0.51) | MAPK1CYP3A4ALDH1A1KYNUTSHR | |
| SCHEMBL6420329 | 0.88 | MEN1 (0.54) | ALDH1A1KYNUALOX15LMNASMN1; SMN2 | |
| SCHEMBL6420324 | 0.88 | MEN1 (0.54) | ALDH1A1KYNUALOX15LMNASMN1; SMN2 | |
| SCHEMBL9683154 | 0.88 | MAPT (0.51) | MAPK1CYP3A4ALDH1A1KYNUTSHR | |
| SCHEMBL11658563 | 0.88 | CTSK (0.58) | CTSLCTSBCTSSCTSK | |
| SCHEMBL31488862 | 0.87 | ALDH1A1 (0.51) | MAPK1CYP3A4ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL345230 | 0.86 | KYNU (0.64) | ALDH1A1KYNUALOX15THRBCYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996027370-A1 | FREE RADICAL SCAVENGER MOLECULES | BRITISH TECHNOLOGY GROUP LIMITED (GB) | 1996-09-12 | — | — | WO | disclosed |