Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.57 |
| ▸ | CA2 | P00918 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CTSK | P43235 | 2/20 | 0.52 |
| ▸ | CASP1 | P29466 | 1/20 | 0.52 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.50 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.50 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.50 |
| ▸ | CTSS | P25774 | 1/20 | 0.48 |
| ▸ | KLK7 | P49862 | 2/20 | 0.47 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.47 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP3 | P08254 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8259105 | 0.88 | CTSS (0.50) | CA1CA2ALDH1A1CTSKPSMB8 | |
| SCHEMBL12285382 | 0.86 | PAX8 (0.51) | MAPTMEN1KMT2ANPSR1ALDH1A1 | |
| SCHEMBL9826450 | 0.85 | KLK7 (0.55) | MAPTCTSSKLK7KLK5 | |
| SCHEMBL17133648 | 0.84 | MAPT (0.64) | CA1CA2MAPTMEN1KMT2A | |
| SCHEMBL16486872 | 0.83 | MEN1 (0.52) | MAPTMEN1KMT2ANPSR1ALDH1A1 | |
| SCHEMBL16486871 | 0.83 | MEN1 (0.52) | MAPTMEN1KMT2ANPSR1ALDH1A1 | |
| SCHEMBL29773945 | 0.83 | MEN1 (0.52) | MAPTMEN1KMT2ANPSR1ALDH1A1 | |
| SCHEMBL12285414 | 0.82 | PSMB8 (0.47) | CA1CA2MAPTNPSR1ALDH1A1 | |
| SCHEMBL19017845 | 0.81 | MAPT (0.49) | CA1CA2MAPTKMT2ANPSR1 | |
| SCHEMBL16847608 | 0.81 | MAPT (0.49) | CA1CA2MAPTKMT2ANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105828840-A | 1- (chloromethyl) -2, 3-dihydro-1H-benzo [ e ] indole dimer antibody-drug conjugate compounds and methods of use and treatment | 基因泰克公司 | 2016-08-03 | — | — | CN | disclosed |