Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | DNTT | P04053 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4124937 | 0.89 | DNTT (0.35) | CYP1A2HIF1ADNTTTSHRALOX12 | |
| SCHEMBL30016667 | 0.78 | CYP1A2 (0.40) | CYP1A2HIF1ADNTTTSHRALDH1A1 | |
| SCHEMBL5254413 | 0.78 | TSHR (0.34) | CYP1A2HIF1ADNTTTSHRALOX12 | |
| SCHEMBL22092594 | 0.77 | CYP1A2 (0.39) | CYP1A2HIF1ATSHROPRK1ALDH1A1 | |
| SCHEMBL11004912 | 0.77 | CYP1A2 (0.39) | CYP1A2HIF1ATSHROPRK1ALDH1A1 | |
| SCHEMBL29328848 | 0.75 | CYP1A2 (0.38) | CYP1A2HIF1ATSHRALDH1A1KDM4E | |
| SCHEMBL22309111 | 0.75 | CYP1A2 (0.38) | CYP1A2HIF1ATSHROPRK1ALDH1A1 | |
| SCHEMBL29329317 | 0.72 | CYP1A2 (0.36) | CYP1A2HIF1AALDH1A1KDM4EKMT2A | |
| SCHEMBL3339309 | 0.70 | CYP1A2 (0.37) | CYP1A2HIF1ATSHRALDH1A1KDM4E | |
| SCHEMBL3236730 | 0.70 | CYP1A2 (0.37) | CYP1A2HIF1ATSHROPRK1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024151112-A1 | PYRAZOLOPYRIMIDINE DERIVATIVE AS CYCLIN-DEPENDENT KINASE 9 INHIBITOR | 주식회사 티움바이오 | 2024-07-18 | — | — | WO | disclosed |