Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16220760 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDTDP1TSHR | |
| SCHEMBL12643021 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDTDP1TSHR | |
| SCHEMBL19224793 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDTDP1TSHR | |
| SCHEMBL23219313 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDTDP1TSHR | |
| SCHEMBL19999691 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDTDP1TSHR | |
| SCHEMBL19224794 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDTDP1TSHR | |
| SCHEMBL16388910 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDTDP1TSHR | |
| SCHEMBL16435349 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDTDP1TSHR | |
| SCHEMBL21074284 | 0.91 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDTDP1TSHR | |
| SCHEMBL11995106 | 0.87 | KDM4E (0.38) | ALDH1A1KDM4EHPGDTDP1TSHR |
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-3126371-B1 | METAL COMPLEXES, COMPRISING CARBENE LIGANDS HAVING AN O-SUBSTITUTED NON-CYCLOMETALATED ARYL GROUP AND THEIR USE IN ORGANIC LIGHT EMITTING DIODES | UDC IRELAND LTD (IE) | 2021-11-10 | — | — | EP | disclosed |