Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.36 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | RORB | Q92753 | 1/20 | 0.34 |
| ▸ | SHMT1 | P34896 | 1/20 | 0.34 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.34 |
| ▸ | MAT2A | P31153 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 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 | |
|---|---|---|---|---|
| SCHEMBL23960860 | 0.80 | KIF11 (0.54) | KIF11MAPK14S1PR1S1PR3 | |
| SCHEMBL23960839 | 0.80 | AAK1 (0.40) | ADORA2AADORA1KIF11IDO1PARP10 | |
| SCHEMBL23960853 | 0.75 | AAK1 (0.38) | IDO1S1PR1S1PR3 | |
| SCHEMBL27333140 | 0.73 | MAP4K4 (0.39) | ADORA2AADORA1 | |
| SCHEMBL29461217 | 0.73 | ADORA2A (0.56) | ADORA2AADORA1TRPA1IDO1CYP19A1 | |
| SCHEMBL2329610 | 0.73 | ADORA2A (0.56) | ADORA2AADORA1TRPA1IDO1CYP19A1 | |
| SCHEMBL31380444 | 0.73 | KIF11 (0.57) | KIF11IDO1S1PR1S1PR3AKR1C2 | |
| SCHEMBL3281593 | 0.73 | KIF11 (0.57) | KIF11IDO1S1PR1S1PR3AKR1C2 | |
| SCHEMBL25070215 | 0.71 | ADORA2A (0.54) | ADORA2AADORA1TRPA1IDO1CYP19A1 | |
| SCHEMBL23960856 | 0.71 | PARP10 (0.44) | KIF11IDO1PARP10PARP11RORC |
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 |
|---|---|---|---|---|---|---|---|
| US-20210332290-A1 | ORGANIC LIGHT-EMITTING MATERIAL BASED ON A PLATINUM TETRADENTATE ONCN COMPLEX, PREPARATION METHOD AND APPLICATION THEREOF IN ORGANIC LIGHT-EMITTING DIODES | GUANGDONG AGLAIA OPTOELECTRONIC MATERIALS CO., LTD (CN) | 2021-10-28 | — | — | US | disclosed |