Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGER1 | P34995 | 4/20 | 0.54 |
| ▸ | PTGER4 | P35408 | 4/20 | 0.54 |
| ▸ | PTGER3 | P43115 | 4/20 | 0.54 |
| ▸ | PTGER2 | P43116 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | NSD2 | O96028 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | FGB | P02675 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 3/20 | 0.47 |
| ▸ | ELANE | P08246 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL5154125 | 0.93 | PTGER1 (0.54) | PTGER1PTGER4PTGER3PTGER2ALDH1A1 | |
| SCHEMBL11102725 | 0.83 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1MEN1POLBKMT2A | |
| SCHEMBL5150190 | 0.83 | ALDH1A1 (0.52) | PTGER1PTGER4PTGER3PTGER2ALDH1A1 | |
| SCHEMBL30455815 | 0.82 | MEN1 (0.45) | PTGER1PTGER4PTGER3PTGER2ALDH1A1 | |
| SCHEMBL2316204 | 0.81 | MEN1 (0.54) | ALDH1A1L3MBTL1MEN1POLBKMT2A | |
| SCHEMBL11585452 | 0.79 | ELANE (0.51) | ALDH1A1L3MBTL1MEN1KMT2ANSD2 | |
| SCHEMBL8875915 | 0.79 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1MEN1POLBKMT2A | |
| SCHEMBL71453 | 0.78 | PTGER4 (0.68) | PTGER1PTGER4PTGER3PTGER2KEAP1 | |
| SCHEMBL10686141 | 0.78 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1MEN1POLBKMT2A | |
| Hydrogen Peroxide SCHEMBL27721287 | 0.78 | ELANE (0.57) | ALDH1A1L3MBTL1NSD2LMNAELANE |
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 |
|---|---|---|---|---|---|---|---|
| US-5650399-A | CONJUGATED WITH TARGET SPECIFIC OLIGONUCLEOTIDE, ACTIVATED BY LIGHT OR CHEMICAL/ENZYMATIC REDUCTION, ALKYLATION AND CROSSLINKING OF BIOLOGICAL MOLECULES SUCH DNA, ANTITUMOR | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1997-07-22 | — | — | US | disclosed |