Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PPIA | P62937 | 2/20 | 0.33 |
| ▸ | ACLY | P53396 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL88302 | 0.82 | HTR2A (0.45) | CYP1A2CYP2D6CYP2C9TSHRCYP2C19 | |
| SCHEMBL29579635 | 0.82 | HTR2A (0.45) | CYP1A2CYP2D6CYP2C9TSHRCYP2C19 | |
| Ammonia Solution, Strong SCHEMBL28099493 | 0.80 | HTR2A (0.44) | CYP1A2CYP2D6CYP2C9TSHRCYP2C19 | |
| Hexane SCHEMBL28816063 | 0.74 | BCHE (0.45) | EPHX2KMT2AMEN1 | |
| SCHEMBL1694504 | 0.72 | PTGS1 (0.39) | CYP2C9TSHR | |
| SCHEMBL27880277 | 0.71 | HTR2A (0.44) | TSHRMAPTEPHX2KMT2APPIA | |
| SCHEMBL2877767 | 0.71 | CYP1A2 (0.50) | CYP1A2CYP2D6CYP2C9TSHRCYP2C19 | |
| Piperidine SCHEMBL5679331 | 0.70 | MAPT (0.42) | TSHRMAPTKMT2A | |
| SCHEMBL28972124 | 0.70 | KMT2A (0.43) | CYP1A2TSHRMAPTEPHX2KMT2A | |
| SCHEMBL28246095 | 0.69 | KMT2A (0.44) | EPHX2KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0888543-A4 | AZATIDE PEPTIDOMIMETICS | SCRIPPS RESEARCH INST (US) | 2004-04-07 | — | — | EP | disclosed |
| US-6664372-B1 | Solution phase synthesis on a soluble homopolymer support by reacting tert-butoxycarbonyl-protected aza-amino acids with bis(pentafluorophenyl) carbonate as carbonyl activation element and coupling to support; combinatorial chemistry | THE SCRIPPS RESEARCH INSTITUTE | 2003-12-16 | — | — | US | disclosed |
| EP-0888543-A1 | AZATIDE PEPTIDOMIMETICS | The Scripps Research Institute (US) | 1999-01-07 | — | — | EP | disclosed |
| WO-1997035199-A9 | AZATIDE PEPTIDOMIMETICS | — | 1997-12-11 | — | — | WO | disclosed |
| WO-1997035199-A1 | AZATIDE PEPTIDOMIMETICS | THE SCRIPPS RESEARCH INSTITUTE (US) | 1997-09-25 | — | — | WO | disclosed |