Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 4/20 | 0.37 |
| ▸ | THRA | P10827 | 3/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 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 | |
|---|---|---|---|---|
| SCHEMBL21154987 | 0.82 | CYP19A1 (0.44) | ALDH1A1KDM4ETDP1CYP1A2CYP2C19 | |
| SCHEMBL8758834 | 0.71 | ALDH1A1 (0.54) | ALDH1A1KDM4ESMN1; SMN2TDP1GFER | |
| SCHEMBL5328061 | 0.70 | KDM4E (0.47) | ALDH1A1KDM4ESMN1; SMN2TDP1GFER | |
| SCHEMBL23640676 | 0.70 | ALDH1A1 (0.32) | ALDH1A1KDM4ETDP1THRBRAB9A | |
| SCHEMBL21531573 | 0.69 | HTR6 (0.37) | ALDH1A1KDM4ETDP1RAB9AKDM4A | |
| SCHEMBL21779797 | 0.69 | HTR6 (0.37) | ALDH1A1KDM4ETDP1RAB9AKDM4A | |
| SCHEMBL24625817 | 0.69 | CYP19A1 (0.48) | ALDH1A1KDM4ETDP1CYP1A2CYP2C19 | |
| SCHEMBL19538924 | 0.68 | GPR3 (0.56) | ALDH1A1KDM4ESMN1; SMN2TDP1CYP1A2 | |
| SCHEMBL19064547 | 0.68 | CYP1A2 (0.71) | ALDH1A1KDM4ESMN1; SMN2TDP1GFER | |
| SCHEMBL19064545 | 0.66 | SMN1; SMN2 (0.84) | ALDH1A1KDM4ESMN1; SMN2TDP1GFER |
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-3904363-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE | Samsung Electronics Co., Ltd. (KR) | 2021-11-03 | — | — | EP | disclosed |