Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 4/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | PTGFR | P43088 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 3/20 | 0.33 |
| ▸ | ACHE | P22303 | 3/20 | 0.33 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28376864 | 0.79 | NR1I2 (0.35) | DHODHSCN10AKCNH2MEN1KMT2A | |
| SCHEMBL14427134 | 0.78 | TERT (0.46) | SCN10AKCNH2MEN1KMT2ATSHR | |
| SCHEMBL2773901 | 0.74 | ALDH1A1 (0.52) | PDE3BPDE3APDE2AP2RY12KMT2A | |
| SCHEMBL30164507 | 0.74 | ALDH1A1 (0.52) | PDE3BPDE3APDE2AP2RY12KMT2A | |
| SCHEMBL29033070 | 0.73 | ALDH1A1 (0.50) | PDE3BPDE3APDE2AP2RY12KMT2A | |
| Iodide SCHEMBL3905318 | 0.73 | ALDH1A1 (0.50) | PDE3BPDE3APDE2AP2RY12KMT2A | |
| Bromide SCHEMBL17508351 | 0.73 | ALDH1A1 (0.50) | PDE3BPDE3APDE2AP2RY12KMT2A | |
| SCHEMBL23118240 | 0.72 | SCN10A (0.47) | SCN10AKCNH2MEN1KMT2ATSHR | |
| SCHEMBL2707266 | 0.72 | SCN10A (0.47) | SCN10AKCNH2MEN1KMT2ATSHR | |
| SCHEMBL15624643 | 0.72 | PDE3B (0.46) | PDE3BPDE3APDE2AP2RY12MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108250111-B | Double-receptor organic light-emitting small molecular material and preparation method and application thereof | 华南理工大学 | 2020-04-28 | — | — | CN | disclosed |
| CN-108164445-B | self-host organic light-emitting small molecular material and preparation method and application thereof | SOUTH CHINA UNIVERSITY OF TECHNOLOGY (CN) | 2019-12-10 | — | — | CN | disclosed |