Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.41 |
| ▸ | IMPDH2 | P12268 | 6/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | TPMT | P51580 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.33 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.33 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6828158 | 0.84 | PTPN1 (0.40) | ALDH1A1KDM4EPTPN1IMPDH2HPGD | |
| SCHEMBL10483765 | 0.82 | ALDH1A1 (0.44) | ALDH1A1HSD17B10KDM4EPTPN1IMPDH2 | |
| SCHEMBL6828168 | 0.79 | PTPN1 (0.48) | ALDH1A1HSD17B10KDM4EPTPN1IMPDH2 | |
| SCHEMBL6828395 | 0.78 | CA2 (0.36) | ALDH1A1PTPN1IMPDH2CA1CA2 | |
| SCHEMBL6825466 | 0.77 | PTPN1 (0.40) | ALDH1A1KDM4EPTPN1IMPDH2HPGD | |
| SCHEMBL27435883 | 0.75 | HCAR2 (0.35) | ALDH1A1HSD17B10KDM4E | |
| SCHEMBL27730255 | 0.74 | PTPN1 (0.44) | ALDH1A1HSD17B10KDM4EPTPN1IMPDH2 | |
| SCHEMBL6828617 | 0.73 | ERN1 (0.34) | PTPN1IMPDH2CA1CA2 | |
| SCHEMBL6825425 | 0.72 | DPP4 (0.36) | ALDH1A1HSD17B10IMPDH2HPGDCYP3A4 | |
| SCHEMBL26882460 | 0.71 | KDM4E (0.44) | ALDH1A1HSD17B10KDM4EIMPDH2HPGD |
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-2004073612-A2 | ESTROGEN RECEPTOR MODULATORS | MERCK & CO. INC. (US) | 2004-09-02 | — | — | WO | disclosed |