Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDGFRB | P09619 | 2/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | DHFR | P00374 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.31 |
| ▸ | SYK | P43405 | 1/20 | 0.31 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.31 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.30 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.30 |
| ▸ | KMO | O15229 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17486283 | 0.85 | IDO1 (0.35) | MAPTGAARAB9AIDO1ALDH1A1 | |
| SCHEMBL17486132 | 0.79 | ALDH1A1 (0.40) | PDGFRBPDGFRAMAPTMEN1GAA | |
| SCHEMBL19295096 | 0.79 | DGAT1 (0.37) | PDGFRB | |
| SCHEMBL17486129 | 0.78 | L3MBTL1 (0.40) | PDGFRBPDGFRAMAPTMEN1GAA | |
| SCHEMBL17486054 | 0.76 | NPC1 (0.37) | RAB9AKMT2AALDH1A1HSD17B10PDK2 | |
| SCHEMBL9764799 | 0.72 | CTDSP1 (0.47) | PDGFRBPDGFRAMAPTGAAKMT2A | |
| SCHEMBL17486236 | 0.71 | SMN1; SMN2 (0.35) | MAPTALDH1A1 | |
| SCHEMBL17486219 | 0.70 | ALDH1A1 (0.35) | MAPTALDH1A1 | |
| SCHEMBL12970528 | 0.70 | FYN (0.48) | MEN1GAARAB9AKMT2ASYK | |
| SCHEMBL19295077 | 0.69 | ALOX5AP (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3174890-B1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2019-03-13 | — | — | EP | disclosed |
| WO-2016015815-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2016-02-04 | — | — | WO | disclosed |