Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | EEF2K | O00418 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | MPO | P05164 | 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 | |
|---|---|---|---|---|
| SCHEMBL11170203 | 0.90 | ALDH1A1 (0.47) | SRCALDH1A1GAACYP1A2TSHR | |
| SCHEMBL12659781 | 0.80 | TDP1 (0.45) | ALDH1A1GAAHPGDKDM4EHSD17B10 | |
| SCHEMBL12672598 | 0.79 | KDM4E (0.35) | ALDH1A1KDM4ERXFP1ELANEPOLB | |
| SCHEMBL13662238 | 0.79 | ALDH1A1 (0.47) | SRCALDH1A1GAACYP1A2TSHR | |
| SCHEMBL11267711 | 0.77 | ALDH1A1 (0.58) | SRCALDH1A1GAACYP1A2TSHR | |
| SCHEMBL7002418 | 0.77 | ELANE (0.38) | SRCALDH1A1GAACYP1A2HPGD | |
| SCHEMBL12659782 | 0.75 | SRC (0.49) | SRCALDH1A1TSHRSIRT2SIRT1 | |
| SCHEMBL5146405 | 0.74 | ELANE (0.39) | SRCALDH1A1GAACYP1A2HPGD | |
| SCHEMBL13567140 | 0.70 | TDP1 (0.49) | ALDH1A1GAAHPGDKDM4EHSD17B10 | |
| SCHEMBL862366 | 0.70 | ALDH1A1 (0.55) | SRCALDH1A1GAACYP1A2TSHR |
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-2008051552-A2 | ORGANIC SEMICONDUCTOR MATERIALS AND METHODS OF PREPARING AND USE THEREOF | NORTHWESTERN UNIVERSITY (US) | 2008-05-02 | — | — | WO | disclosed |