Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | CA12 | O43570 | 4/20 | 0.45 |
| ▸ | CA1 | P00915 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 4/20 | 0.45 |
| ▸ | CA9 | Q16790 | 4/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.45 |
| ▸ | CA3 | P07451 | 3/20 | 0.45 |
| ▸ | CA4 | P22748 | 3/20 | 0.45 |
| ▸ | CA7 | P43166 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | MB | P02144 | 1/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | RARG | P13631 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7767271 | 0.79 | NPSR1 (0.46) | ALDH1A1MEN1CYP3A4KMT2ATSHR | |
| SCHEMBL27453795 | 0.77 | SMN1; SMN2 (0.34) | ALDH1A1MEN1KMT2AKDM4EAPP | |
| SCHEMBL27519577 | 0.77 | ALDH1A1 (0.47) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL10292556 | 0.76 | ALDH1A1 (0.45) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL7153902 | 0.76 | ESR1 (0.47) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL30127710 | 0.76 | ALDH1A1 (0.43) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL1981807 | 0.74 | SMN1; SMN2 (0.53) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL874035 | 0.74 | ALDH1A1 (0.41) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL5663915 | 0.73 | ESR1 (0.41) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL10863831 | 0.73 | CA2 (0.40) | ALDH1A1MAPTCA12CA1CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101594886-A | Radiographical moieties coupled to peptidase-binding moieties for imaging tissues and organs expressing peptidases | MOLECULAR INSIGHT PHARM INC (US) | 2009-12-02 | — | — | CN | disclosed |
| EP-0201633-A2 | Substituted anilide compounds and their use | ABBOTT LABORATORIES (US) | 1986-11-20 | — | — | EP | disclosed |