Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | DGKA | P23743 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | PAM | P19021 | 2/20 | 0.48 |
| ▸ | CES2 | O00748 | 4/20 | 0.48 |
| ▸ | CES1 | P23141 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.44 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL12502129 | 0.98 | TSHR (0.58) | ALDH1A1TSHRDGKALMNAPAM | |
| SCHEMBL28104758 | 0.98 | TSHR (0.58) | ALDH1A1TSHRDGKALMNAPAM | |
| SCHEMBL3642176 | 0.93 | ALDH1A1 (0.54) | ALDH1A1TSHRDGKALMNAPAM | |
| SCHEMBL2790146 | 0.87 | TERT (0.58) | LMNAMAPTTP53PPARGPPARD | |
| SCHEMBL21599132 | 0.87 | TERT (0.58) | LMNAMAPTTP53PPARGPPARD | |
| SCHEMBL27580692 | 0.85 | ALDH1A1 (0.65) | ALDH1A1TSHRDGKALMNAPAM | |
| SCHEMBL1783 | 0.85 | ALDH1A1 (0.65) | ALDH1A1TSHRDGKALMNAPAM | |
| SCHEMBL3366257 | 0.83 | DGKA (0.67) | ALDH1A1TSHRDGKALMNAPAM | |
| SCHEMBL2727904 | 0.83 | DGKA (0.67) | ALDH1A1TSHRDGKALMNAPAM | |
| SCHEMBL15527970 | 0.83 | DGKA (0.67) | ALDH1A1TSHRDGKALMNAPAM |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112851494-B | Preparation method of 1-pyrene butyric acid | 苏州昊帆生物股份有限公司 | 2023-08-15 | — | — | CN | claimed |
| CN-112851494-B | Preparation method of 1-pyrene butyric acid | 苏州昊帆生物股份有限公司 | 2023-08-15 | — | — | CN | disclosed |
| CN-112851494-A | Preparation method of 1-pyrenebutyric acid | 苏州昊帆生物股份有限公司 | 2021-05-28 | — | — | CN | disclosed |
| US-6268354-B1 | Pharmaceutical composition for antagonizing CCR5 comprising anilide derivative | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-07-31 | — | — | US | disclosed |
| US-4123610-A | Nucleic acid crosslinking agent and affinity inactivation of nucleic acids therewith | THE UNITED STATES GOVERNMENT (US) | 1978-10-31 | — | — | US | disclosed |