Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | CCL2 | P13500 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.30 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.30 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28029305 | 0.71 | GABRP (0.31) | — | |
| SCHEMBL23058910 | 0.67 | ALDH1A1 (0.38) | HTTKMT2A | |
| SCHEMBL3000591 | 0.67 | BRD4 (0.41) | HTTBRD4CCL2CYP1A2CYP3A4 | |
| SCHEMBL23058912 | 0.67 | ALDH1A1 (0.38) | HTTKMT2A | |
| SCHEMBL22275567 | 0.66 | — | — | |
| SCHEMBL3011281 | 0.63 | KMT2A (0.36) | KMT2ASLC22A2SLC22A1SLC22A3SLC6A4 | |
| SCHEMBL24355003 | 0.61 | HTT (0.36) | HTTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL24032433 | 0.61 | HTT (0.36) | HTT | |
| SCHEMBL16001320 | 0.61 | ALDH1A1 (0.40) | BRD4CYP1A2CYP3A4CYP2D6KMT2A | |
| SCHEMBL6903276 | 0.61 | HTT (0.36) | HTTKMT2A |
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-3770166-A1 | ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | Samsung Electronics Co., Ltd. (KR) | 2021-01-27 | — | — | EP | disclosed |