Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | BRD4 | O60885 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20860298 | 0.71 | CYP3A4 (0.33) | NPC1CYP3A4TDP1TSHRSMN1; SMN2 | |
| SCHEMBL22415041 | 0.70 | CYP3A4 (0.37) | ALDH1A1HSD17B10CYP3A4TDP1MEN1 | |
| SCHEMBL22537040 | 0.69 | MAOA (0.41) | ALDH1A1BRD4HSD17B10KDM4ENPC1 | |
| SCHEMBL12992750 | 0.68 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1HSD17B10KDM4ENPC1 | |
| SCHEMBL22213402 | 0.68 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1HSD17B10KDM4ENPC1 | |
| SCHEMBL23839185 | 0.68 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1BRD4HSD17B10KDM4E | |
| SCHEMBL23640904 | 0.68 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1BRD4HSD17B10KDM4E | |
| SCHEMBL19052298 | 0.67 | — | — | |
| SCHEMBL24083966 | 0.66 | TAAR1 (0.41) | ALDH1A1HSD17B10NPC1CYP3A4TDP1 | |
| SCHEMBL22298316 | 0.64 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1BRD4HSD17B10KDM4E |
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-3461830-B1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND | SAMSUNG ELECTRONICS CO LTD (KR) | 2021-01-20 | — | — | EP | disclosed |
| EP-3461830-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND | Samsung Electronics Co., Ltd. (KR) | 2019-04-03 | — | — | EP | disclosed |