Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | GABRP | O00591 | 1/20 | 0.44 |
| ▸ | GABRD | O14764 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.44 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.44 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.44 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.44 |
| ▸ | GABRE | P78334 | 1/20 | 0.44 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.44 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.44 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.44 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.44 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27167088 | 0.83 | NR3C2 (0.39) | KDM4EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL29009956 | 0.81 | FFAR1 (0.46) | — | |
| SCHEMBL8323881 | 0.81 | RAB9A (0.60) | KDM4ESMN1; SMN2RAB9ACYP1A2MAPT | |
| SCHEMBL4015404 | 0.79 | SMN1; SMN2 (0.43) | SMN1; SMN2CYP1A2 | |
| SCHEMBL17396955 | 0.77 | KDM4E (0.53) | KDM4ESMN1; SMN2GABRPGABRDGABRA1 | |
| SCHEMBL27837098 | 0.77 | GABRA5 (0.53) | KDM4EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL27791980 | 0.77 | GABRA5 (0.44) | KDM4EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL3548760 | 0.77 | KDM4E (0.47) | KDM4EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL7914812 | 0.77 | GABRP (0.44) | KDM4EGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL17396703 | 0.77 | AGBL2 (0.47) | SMN1; SMN2GABRPGABRDGABRA1GABRB1 |
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-116023375-A | Heterocyclic derivative, preparation method and application thereof | 成都苑东生物制药股份有限公司 | 2023-04-28 | — | — | CN | disclosed |
| CN-114805346-A | Heterocyclic derivative, preparation method and application thereof | 成都硕德药业有限公司 | 2022-07-29 | — | — | CN | disclosed |