Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | DRD3 | P35462 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | C1S | P09871 | 1/20 | 0.31 |
| ▸ | INSR | P06213 | 3/20 | 0.31 |
| ▸ | IGF1R | P08069 | 3/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | LCK | P06239 | 2/20 | 0.30 |
| ▸ | LYN | P07948 | 2/20 | 0.30 |
| ▸ | KIT | P10721 | 2/20 | 0.30 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.30 |
| ▸ | SRC | P12931 | 2/20 | 0.30 |
| ▸ | FLT1 | P17948 | 2/20 | 0.30 |
| ▸ | FLT4 | P35916 | 2/20 | 0.30 |
| ▸ | KDR | P35968 | 2/20 | 0.30 |
| ▸ | FLT3 | P36888 | 2/20 | 0.30 |
| ▸ | ERBB4 | Q15303 | 2/20 | 0.30 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL30941307 | 0.99 | KCNH2 (0.32) | DRD2DRD4DRD3KCNH2CNR1 | |
| SCHEMBL25047889 | 0.97 | IGF1R (0.32) | DRD2DRD4DRD3KCNH2CNR1 | |
| SCHEMBL31618049 | 0.93 | CNR1 (0.36) | DRD2DRD4DRD3KCNH2CNR1 | |
| SCHEMBL30941197 | 0.93 | CNR1 (0.36) | DRD2DRD4DRD3KCNH2CNR1 | |
| SCHEMBL25047576 | 0.93 | CNR1 (0.36) | DRD2DRD4DRD3KCNH2CNR1 | |
| SCHEMBL25047574 | 0.93 | CNR1 (0.36) | DRD2DRD4DRD3KCNH2CNR1 | |
| SCHEMBL25047793 | 0.92 | C1S (0.33) | DRD2DRD4DRD3C1SCA2 | |
| SCHEMBL25048044 | 0.91 | C1S (0.31) | DRD2DRD4DRD3C1SCA2 | |
| SCHEMBL25049338 | 0.91 | CA2 (0.32) | DRD2DRD4DRD3C1SCA2 | |
| SCHEMBL31617955 | 0.91 | C1S (0.31) | DRD2DRD4DRD3C1SCA2 |
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-2023017152-A1 | SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION | ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) | 2023-02-16 | — | — | WO | disclosed |