Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 9/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HTR2A | P28223 | 3/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HTR3A | P46098 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8508589 | 0.78 | ALDH1A1 (0.54) | CA2CA5AALDH1A1SLC6A2MAPT | |
| SCHEMBL4408306 | 0.76 | ALDH1A1 (0.64) | CA2CA5AALDH1A1CYP1A2MAPT | |
| SCHEMBL10408278 | 0.75 | TAAR1 (0.54) | CA2CA5ATAAR1ALDH1A1HTR2A | |
| SCHEMBL126505 | 0.75 | CA2 (0.54) | CA2CA5AALDH1A1CYP1A2KDM4E | |
| SCHEMBL7692257 | 0.75 | HTR2C (0.55) | CA2CA5ATAAR1ALDH1A1HTR2A | |
| SCHEMBL28985623 | 0.75 | ALDH1A1 (0.40) | CA2CA5AALDH1A1MAPTPOLB | |
| SCHEMBL12069191 | 0.74 | CYP2A6 (0.52) | CA2CA5ATAAR1ALDH1A1CYP2A6 | |
| SCHEMBL224548 | 0.74 | TAAR1 (0.72) | CA2CA5ATAAR1ALDH1A1HTR2A | |
| SCHEMBL10084209 | 0.73 | FFAR1 (0.53) | CA2 | |
| SCHEMBL7921161 | 0.73 | CA2 (0.52) | CA2CA5AALDH1A1CYP1A2KDM4E |
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-2023069711-A1 | FAP-TARGETED NEUTRON CAPTURE AGENTS, AND USES AND FORMULATIONS RELATED THERETO | TRUSTEES OF TUFTS COLLEGE (US) | 2023-04-27 | — | — | WO | disclosed |