Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.39 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | PRKACA | P17612 | 1/20 | 0.39 |
| ▸ | FLT1 | P17948 | 1/20 | 0.39 |
| ▸ | LTK | P29376 | 1/20 | 0.39 |
| ▸ | GRK5 | P34947 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.39 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | CLK2 | P49760 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
| ▸ | CDK9 | P50750 | 1/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31661861 | 0.82 | BCAT2 (0.54) | BCAT2DAPK3PRKD3PIM1PRKACA | |
| SCHEMBL29922877 | 0.79 | BCAT2 (0.66) | BCAT2KDRMAPK8RAB9APOLB | |
| SCHEMBL6669302 | 0.77 | BCAT2 (0.68) | BCAT2CYP2A6LIMK1CHEK2LMNA | |
| SCHEMBL31661820 | 0.77 | BCAT2 (0.58) | BCAT2DAPK3PRKD3PIM1PRKACA | |
| SCHEMBL6667283 | 0.74 | BCAT2 (0.69) | BCAT2CDK8CHEK2 | |
| SCHEMBL15267071 | 0.73 | BCAT2 (0.54) | BCAT2CSNK1A1DYRK1BRAB9ANPC1 | |
| SCHEMBL31661908 | 0.72 | BCAT2 (0.53) | BCAT2KDRCHEK2KDM4EGABRA1 | |
| SCHEMBL4445671 | 0.71 | BCAT2 (1.00) | BCAT2MAPK8GABRA1GABRG2GABRB3 | |
| SCHEMBL31561155 | 0.70 | BCAT2 (0.47) | BCAT2KDRMAPK8SMN1; SMN2POLB | |
| SCHEMBL31661900 | 0.70 | BCAT2 (0.57) | BCAT2LIMK1CHEK2POLBKDM4E |
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-2025151311-A1 | NICOTINAMIDE DERIVATIVES | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2025-07-17 | — | — | WO | disclosed |