Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 4/20 | 0.41 |
| ▸ | PYCR1 | P32322 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | AGER | Q15109 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5672968 | 0.76 | IDO1 (0.48) | TAAR1IDO1 | |
| SCHEMBL2561988 | 0.75 | TAAR1 (0.50) | TAAR1HTR2ACYP2A6IDO1 | |
| SCHEMBL12374395 | 0.74 | ALDH1A1 (0.50) | ALDH1A1ALOX15MAPK1 | |
| SCHEMBL5183493 | 0.74 | TAAR1 (0.42) | TAAR1HTR2ACYP2A6IDO1PYCR1 | |
| SCHEMBL10204783 | 0.74 | IDO1 (0.39) | IDO1 | |
| SCHEMBL855864 | 0.74 | TP53 (0.43) | TAAR1CYP2A6IDO1ALDH1A1MAPK1 | |
| SCHEMBL3538182 | 0.74 | IDO1 (0.46) | TAAR1HTR2ACYP2A6IDO1ALDH1A1 | |
| SCHEMBL4890253 | 0.74 | IDO1 (0.46) | TAAR1CYP2A6IDO1ALDH1A1ALOX15 | |
| Hydrochloric Acid SCHEMBL3248101 | 0.72 | TAAR1 (0.41) | TAAR1HTR2ACYP2A6IDO1PYCR1 | |
| SCHEMBL1550703 | 0.72 | TAAR1 (0.50) | TAAR1IDO1PYCR1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115611881-A | Method for synthesizing novel VHL ligand 4-F-VH032 | 复旦大学 | 2023-01-17 | — | — | CN | claimed |
| CN-110520413-B | Macrocyclic broad spectrum antibiotics | 阿奇克斯制药公司 | 2023-02-17 | — | — | CN | disclosed |
| CN-115611881-A | Method for synthesizing novel VHL ligand 4-F-VH032 | 复旦大学 | 2023-01-17 | — | — | CN | disclosed |
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |
| WO-2009145721-A1 | ISOINDOLINE DERIVATIVES COMPRISING PHENYL GROUPS AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS | ASTRAZENECA AB (SE) | 2009-12-03 | — | — | WO | disclosed |
| WO-2009145718-A1 | ISOINDOLINE DERIVATIVES COMPRISING AN ADDITIONAL HETEROCYCLIC GROUP AND THEIR USE IN THE TREATMENT OF PAIN DISORDERS | ASTRAZENECA AB (SE) | 2009-12-03 | — | — | WO | disclosed |