Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | KDM4A | O75164 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.31 |
| ▸ | HTR1A | P08908 | 2/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.31 |
| ▸ | DRD3 | P35462 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL21531573 | 0.82 | HTR6 (0.37) | HTR6CA1CA2KDM4ERAB9A | |
| SCHEMBL13956687 | 0.82 | CA1 (0.40) | HTR6CA1CA2KDM4ERAB9A | |
| SCHEMBL13957372 | 0.81 | CA1 (0.41) | HTR6CA1CA2KDM4EHSD17B10 | |
| SCHEMBL21154987 | 0.79 | CYP19A1 (0.44) | KDM4EHSD17B10KDM4ALMNAALDH1A1 | |
| SCHEMBL13538135 | 0.75 | ALDH1A1 (0.45) | CA1CA2KDM4ERAB9AHSD17B10 | |
| SCHEMBL25638913 | 0.72 | PDE5A (0.43) | KDM4ERAB9AHSD17B10LMNACHRM2 | |
| SCHEMBL17194083 | 0.72 | CYP1A2 (0.53) | HTR6CA1CA2KDM4EHSD17B10 | |
| SCHEMBL30223689 | 0.70 | ALDH1A1 (0.39) | CA1CA2KDM4EHSD17B10CHRM2 | |
| SCHEMBL22212600 | 0.69 | KDM4E (0.43) | KDM4EHSD17B10LMNAALDH1A1GLA | |
| SCHEMBL23986120 | 0.69 | ALDH1A1 (0.47) | KDM4ERAB9AHSD17B10KDM4ALMNA |
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-3617215-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND | Samsung Electronics Co., Ltd. (KR) | 2020-03-04 | — | — | EP | disclosed |