Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 2/20 | 0.35 |
| ▸ | KRAS | P01116 | 1/20 | 0.33 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL24675070 | 1.00 | MEN1 (0.36) | MEN1NPC1RAB9AKMT2AATM | |
| SCHEMBL24675059 | 1.00 | MEN1 (0.36) | MEN1NPC1RAB9AKMT2AATM | |
| SCHEMBL24675019 | 0.77 | HTR2A (0.34) | HTR2AHTR2CHTR2BKRASSOS1 | |
| SCHEMBL24675018 | 0.77 | HTR2A (0.34) | HTR2AHTR2CHTR2BKRASSOS1 | |
| SCHEMBL24675032 | 0.77 | HTR2A (0.34) | HTR2AHTR2CHTR2BKRASSOS1 | |
| SCHEMBL24675074 | 0.74 | HTR2A (0.37) | HTR2AHTR2CHTR2BSOS1 | |
| SCHEMBL24675062 | 0.73 | HTR2A (0.43) | MEN1KMT2AHTR2AHTR2CHTR2B | |
| SCHEMBL24675075 | 0.73 | HTR2A (0.43) | MEN1KMT2AHTR2AHTR2CHTR2B | |
| SCHEMBL26958161 | 0.72 | HTR2A (0.40) | HTR2AHTR2CHTR2BSOS1HDAC1 | |
| SCHEMBL26958085 | 0.70 | TIPARP (0.39) | ATMHTR2AHTR2CHTR2BPARP1 |
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-2022223022-A1 | FUSED-RING HETEROCYCLE DERIVATIVE AND MEDICAL APPLICATION THEREOF | 四川海思科制药有限公司 | 2022-10-27 | — | — | WO | disclosed |