Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 6/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.35 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6878044 | 1.00 | MCHR1 (0.40) | MCHR1ADRA2ANPY5RACHEBACE1 | |
| SCHEMBL6876696 | 0.93 | MCHR1 (0.39) | MCHR1ADRA2ANPY5RACHEBACE1 | |
| SCHEMBL6463259 | 0.93 | MCHR1 (0.39) | MCHR1ADRA2ANPY5RACHEBACE1 | |
| SCHEMBL6875957 | 0.88 | ACHE (0.41) | MCHR1ADRA2AACHEBACE1KDM4E | |
| SCHEMBL6875945 | 0.88 | ACHE (0.41) | MCHR1ADRA2AACHEBACE1KDM4E | |
| SCHEMBL6873584 | 0.87 | MCHR1 (0.42) | MCHR1ADRA2ANPY5RACHEBACE1 | |
| SCHEMBL6873577 | 0.87 | MCHR1 (0.42) | MCHR1ADRA2ANPY5RACHEBACE1 | |
| SCHEMBL6875669 | 0.87 | MCHR1 (0.41) | MCHR1ADRA2ANPY5RACHEBACE1 | |
| SCHEMBL6455824 | 0.87 | MCHR1 (0.46) | MCHR1ADRA2ANPY5RACHEBACE1 | |
| SCHEMBL6875477 | 0.87 | KCNH2 (0.43) | MCHR1ADRA2ANPY5RACHEDRD2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004087669-A1 | NOVEL QUINOLINE, TETRAHYDROQUINAZOLINE, AND PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF | TAISHO PHARMACEUTICAL CO. LTD. (JP) | 2004-10-14 | — | — | WO | claimed |
| EP-1464335-A2 | Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist | Taisho Pharmaceutical Co. Ltd. (JP) | 2004-10-06 | — | — | EP | disclosed |