Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | GPR3 | P46089 | 1/20 | 0.44 |
| ▸ | NCF1 | P14598 | 2/20 | 0.44 |
| ▸ | GSK3B | P49841 | 3/20 | 0.40 |
| ▸ | GSK3A | P49840 | 2/20 | 0.40 |
| ▸ | AURKA | O14965 | 2/20 | 0.40 |
| ▸ | SRC | P12931 | 2/20 | 0.40 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18622337 | 0.82 | HTT (0.42) | CYP1A2GPR3NCF1GSK3BGSK3A | |
| SCHEMBL18622330 | 0.75 | CYP1A2 (0.44) | CYP1A2ALDH1A1HPGDGPR3KMT2A | |
| SCHEMBL422358 | 0.72 | PDE10A (0.61) | PDE10ACYP1A2ALDH1A1HPGDNUDT1 | |
| SCHEMBL20411752 | 0.71 | TP53 (0.49) | CYP1A2ALDH1A1GSK3BGSK3AAURKA | |
| SCHEMBL20411754 | 0.70 | NTRK1 (0.39) | GSK3BGSK3AAURKASRCEIF2AK2 | |
| SCHEMBL1773863 | 0.70 | RAB9A (0.61) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL19169418 | 0.69 | PDE10A (0.60) | PDE10ACYP1A2ALDH1A1HPGDNUDT1 | |
| SCHEMBL4895919 | 0.69 | KDM4E (0.50) | CYP1A2ALDH1A1HPGDGSK3BGSK3A | |
| SCHEMBL20233980 | 0.69 | PDE10A (0.59) | PDE10ACYP1A2ALDH1A1HPGDNUDT1 | |
| SCHEMBL19169883 | 0.69 | GPR3 (0.53) | PDE10ACYP1A2ALDH1A1HPGDNUDT1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9595683-B2 | Organometallic compounds and organic light emitting devices including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-03-14 | — | — | US | disclosed |
| US-9595683-B2 | Organometallic compounds and organic light emitting devices including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-03-14 | — | — | US | disclosed |