Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 4/20 | 0.44 |
| ▸ | DDO | Q99489 | 3/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.36 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL30355112 | 0.85 | HTR6 (0.47) | DAODDOHTR2CKDM4EALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL30355121 | 0.85 | HTR6 (0.47) | DAODDOHTR2CKDM4EALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL30355113 | 0.84 | RAB9A (0.49) | DHODHKDM4EALDH1A1IDO1HSD17B10 | |
| Trifluoroacetic Acid SCHEMBL30355119 | 0.83 | NEK1 (0.39) | DAODDODHODHNEK1 | |
| Trifluoroacetic Acid SCHEMBL30355116 | 0.83 | NEK1 (0.39) | DAODDODHODHNEK1 | |
| Trifluoroacetic Acid SCHEMBL30355103 | 0.81 | MAPK1 (0.51) | DAODDOKDM4EALDH1A1HSD17B10 | |
| Trifluoroacetic Acid SCHEMBL30355104 | 0.79 | TAAR1 (0.40) | DAODDOHTR2CDHODHALDH1A1 | |
| SCHEMBL11115863 | 0.73 | DAO (0.70) | DAODDOHTR2CKDM4EALDH1A1 | |
| SCHEMBL4426955 | 0.73 | DAO (0.56) | DAODDOKDM4EALDH1A1HSD17B10 | |
| SCHEMBL30120739 | 0.72 | HTR2C (0.45) | DAODDOHTR2CIDO1HSD17B10 |
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-2023060255-A1 | QUINOLONE ALKYL AMINES AS NOVEL SEROTONIN 2A RECEPTOR (5HT2AR) AGONISTS | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2023-04-13 | — | — | WO | disclosed |