Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 2/20 | 0.44 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.43 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.43 |
| ▸ | KAT6A | Q92794 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.37 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.37 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.36 |
| ▸ | MPL | P40238 | 3/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23590671 | 0.87 | CTSS (0.35) | CTSSTAS1R3TAS1R1TAS1R2KAT6A | |
| SCHEMBL23590813 | 0.82 | CTSS (0.35) | CTSSTAS1R3TAS1R1TAS1R2KAT6A | |
| SCHEMBL14394310 | 0.82 | LMNA (0.50) | LMNAGAATAS2R14CNR2 | |
| SCHEMBL377350 | 0.81 | CTSS (0.51) | CTSSTAS1R3TAS1R1TAS1R2KAT6A | |
| SCHEMBL23590631 | 0.81 | CTSS (0.44) | CTSSTAS1R3TAS1R1TAS1R2KAT6A | |
| SCHEMBL29723227 | 0.81 | CTSS (0.51) | CTSSTAS1R3TAS1R1TAS1R2KAT6A | |
| SCHEMBL17134419 | 0.78 | CTSS (0.43) | CTSSTAS1R3TAS1R1TAS1R2KAT6A | |
| SCHEMBL17134418 | 0.78 | CTSS (0.43) | CTSSTAS1R3TAS1R1TAS1R2KAT6A | |
| SCHEMBL28188796 | 0.76 | KAT6A (0.51) | CTSSTAS1R3TAS1R1TAS1R2KAT6A | |
| SCHEMBL14040983 | 0.75 | CES2 (0.56) | KAT6AGAA |
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-2023118250-A1 | 8-AZA QUINAZOLINES AS BRAIN-PENETRANT SOS1-INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2023-06-29 | — | — | WO | disclosed |