Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 4/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPY1R | P25929 | 1/20 | 0.37 |
| ▸ | NPY4R | P50391 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 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 SCHEMBL20677193 | 1.00 | PTGS1 (0.44) | PTGS1PTGS2SMN1; SMN2HTTHPGD | |
| SCHEMBL17841851 | 0.92 | HTT (0.49) | PTGS1PTGS2SMN1; SMN2HTTHPGD | |
| SCHEMBL17841853 | 0.92 | HTT (0.49) | PTGS1PTGS2SMN1; SMN2HTTHPGD | |
| Trifluoroacetic Acid SCHEMBL29467754 | 0.91 | MGLL (0.40) | PTGS1PTGS2NPY1RNPY4RMGLL | |
| Ethane SCHEMBL20263693 | 0.90 | HTT (0.50) | PTGS1PTGS2SMN1; SMN2HTTHPGD | |
| SCHEMBL16580150 | 0.88 | MGLL (0.45) | PTGS1PTGS2SMN1; SMN2HTTHPGD | |
| Trifluoroacetic Acid SCHEMBL20263649 | 0.84 | PKM (0.41) | SMN1; SMN2NPY1RNPY4RMGLLALDH1A1 | |
| SCHEMBL20550737 | 0.84 | PTGS1 (0.52) | PTGS1PTGS2SMN1; SMN2HTTHPGD | |
| SCHEMBL28641457 | 0.84 | PTGS1 (0.52) | PTGS1PTGS2SMN1; SMN2HTTHPGD | |
| Trifluoroacetic Acid SCHEMBL28645461 | 0.83 | PKM (0.41) | SMN1; SMN2NPY1RNPY4RMGLLALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114917361-A | Antibody Drug Conjugates (ADC) and antibody prodrug conjugates (APDC) with enzyme cleavable groups | 拜耳医药股份有限公司 | 2022-08-19 | — | — | CN | disclosed |
| CN-107635586-B | Antibody-drug conjugates (ADC) of KSP inhibitors with aglycosylated anti-TWEAKR antibodies | 拜耳医药股份有限公司 | 2021-09-24 | — | — | CN | disclosed |
| EP-3432934-A1 | PRODRUGS OF CYTOTOXIC ACTIVE AGENTS HAVING ENZYMATICALLY CLEAVABLE GROUPS | Bayer Pharma Aktiengesellschaft (DE) | 2019-01-30 | — | — | EP | disclosed |