Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.38 |
| ▸ | KIF11 | P52732 | 2/20 | 0.36 |
| ▸ | TACR1 | P25103 | 2/20 | 0.36 |
| ▸ | TACR3 | P29371 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6829064 | 0.85 | CYP3A4 (0.40) | MEN1ALDH1A1CYP3A4MAPTTDP1 | |
| SCHEMBL29715005 | 0.83 | MAPT (0.53) | TACR1TACR3ALDH1A1CYP3A4MAPT | |
| SCHEMBL5102164 | 0.77 | MEN1 (0.40) | MEN1SIGMAR1HTR2AHTR2CHTR2B | |
| SCHEMBL34420059 | 0.76 | MEN1 (0.41) | MEN1SIGMAR1HTR2AHTR2CHTR2B | |
| SCHEMBL7175933 | 0.76 | MEN1 (0.41) | MEN1SIGMAR1HTR2AHTR2CHTR2B | |
| SCHEMBL27852609 | 0.74 | ALDH1A1 (0.41) | MEN1HTR2AHTR2CALDH1A1CYP3A4 | |
| SCHEMBL27372453 | 0.74 | KIF11 (0.40) | MEN1KIF11HTR2ANPSR1TSHR | |
| SCHEMBL9809143 | 0.74 | MEN1 (0.40) | MEN1SIGMAR1HTR2AHTR2CHTR2B | |
| SCHEMBL28312964 | 0.73 | TDP1 (0.40) | MEN1HTR2AHTR2CALDH1A1CYP3A4 | |
| SCHEMBL9845298 | 0.72 | ALDH1A1 (0.60) | MEN1HTR2AALDH1A1CYP3A4MAPT |
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-101679273-A | 1-substituted tetrahydroisoquinoline compound | ASTELLAS PHARMA INC | 2010-03-24 | — | — | CN | disclosed |