Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | G6PD | P11413 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CCR6 | P51684 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL19113576 | 0.77 | — | — | |
| SCHEMBL27470244 | 0.75 | CYP3A4 (0.44) | ALDH1A1ALOX15HSD17B10TSHRTDP1 | |
| SCHEMBL20156578 | 0.75 | CYP3A4 (0.44) | ALDH1A1ALOX15HSD17B10TSHRTDP1 | |
| SCHEMBL19558004 | 0.75 | MAPT (0.39) | ALDH1A1HPGDALOX15HSD17B10TSHR | |
| SCHEMBL13284210 | 0.74 | HSP90AB1 (0.52) | ALDH1A1HPGDALOX15HSD17B10TSHR | |
| SCHEMBL20133776 | 0.72 | ESR1 (0.34) | ESR1 | |
| SCHEMBL20156488 | 0.71 | L3MBTL1 (0.36) | ALDH1A1HPGDHSD17B10TSHRKDM4E | |
| SCHEMBL12676202 | 0.70 | CA12 (0.48) | RECQLKDM4EMAPTGAACA12 | |
| SCHEMBL23742537 | 0.69 | UHRF1 (0.36) | CYP1A2 | |
| SCHEMBL14308410 | 0.69 | HPGD (0.40) | ALDH1A1HPGDALOX15HSD17B10TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3033405-B1 | MATERIALS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2018-05-09 | — | — | EP | disclosed |