Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5734703 | 0.84 | KDM4E (0.41) | MAOBMAOAHTR2CHTR2B | |
| SCHEMBL6026785 | 0.84 | ADRB1 (0.43) | MAOBMAOAHTR2CCHRNB2CHRNB4 | |
| SCHEMBL27326756 | 0.83 | HTR3A (0.47) | MAOBHTR2AHTR2CHTR2BCHRNA7 | |
| SCHEMBL3279337 | 0.83 | CHRNB2 (0.36) | ESR2CHRNB2CHRNB4CHRNA3CHRNA7 | |
| SCHEMBL3976295 | 0.82 | CHRNB2 (0.55) | HTR2AHTR2CHTR2BCHRNB2CHRNB4 | |
| SCHEMBL470846 | 0.82 | CHRNB2 (0.55) | HTR2AHTR2CHTR2BCHRNB2CHRNB4 | |
| SCHEMBL18913839 | 0.82 | CHRNB2 (0.55) | HTR2AHTR2CHTR2BCHRNB2CHRNB4 | |
| SCHEMBL1579434 | 0.82 | CHRNB2 (0.55) | HTR2AHTR2CHTR2BCHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL27673502 | 0.81 | CHRNB2 (0.53) | HTR2AHTR2CHTR2BCHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL1722775 | 0.81 | CHRNB2 (0.53) | HTR2AHTR2CHTR2BCHRNB2CHRNB4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5648368-A | ANTICOAGULANTS | MERCK & CO., INC. (US) | 1997-07-15 | — | — | US | disclosed |
| WO-1994012181-A1 | FIBRINOGEN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1994-06-09 | — | — | WO | disclosed |