Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 3/20 | 0.43 |
| ▸ | ELANE | P08246 | 2/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HBB | P68871 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2397940 | 0.83 | TTR (0.46) | TTRELANECYP1A1CYP1A2ALDH1A1 | |
| SCHEMBL8876073 | 0.81 | TTR (0.41) | TTRELANECYP1A1CYP1A2ALDH1A1 | |
| SCHEMBL7160042 | 0.77 | NPSR1 (0.51) | TTRMEN1KMT2ANSD2 | |
| SCHEMBL6905929 | 0.75 | ELANE (0.52) | TTRELANECYP1A1CYP1A2ALDH1A1 | |
| SCHEMBL15848431 | 0.74 | ALDH1A1 (0.46) | ELANEALDH1A1CYP3A4L3MBTL1MAPK1 | |
| SCHEMBL8874594 | 0.74 | TTR (0.44) | TTRELANECYP1A1CYP1A2ALDH1A1 | |
| SCHEMBL8876477 | 0.73 | TTR (0.43) | TTRELANECYP1A1CYP1A2ALDH1A1 | |
| SCHEMBL8876069 | 0.72 | TTR (0.40) | TTRELANEALDH1A1SMN1; SMN2AURKB | |
| SCHEMBL2256190 | 0.70 | ADORA2A (0.53) | TTRELANECYP1A1CYP1A2ALDH1A1 | |
| SCHEMBL21451669 | 0.70 | TTR (0.46) | TTRELANECYP1A1CYP1A2ALDH1A1 |
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 |