Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8936116 | 1.00 | MAOB (0.47) | MAOBALDH1A1CYP1A2MAPK1TSHR | |
| SCHEMBL17986869 | 0.84 | MAOB (0.42) | MAOBALDH1A1CYP1A2MAPK1TSHR | |
| SCHEMBL31228482 | 0.83 | ALDH1A1 (0.41) | MAOBALDH1A1CYP1A2MAPK1TSHR | |
| SCHEMBL27968570 | 0.80 | ALDH1A1 (0.56) | MAOBALDH1A1CYP1A2TSHRLMNA | |
| SCHEMBL8986000 | 0.77 | OPRK1 (0.49) | ALDH1A1CYP1A2SLC6A2SLC6A4ADRA1A | |
| SCHEMBL12265182 | 0.77 | TSHR (0.47) | ALDH1A1CYP1A2TSHRLMNACYP3A4 | |
| Hydrochloric Acid SCHEMBL31094860 | 0.75 | ALDH1A1 (0.48) | ALDH1A1CYP1A2MAPK1TSHRLMNA | |
| SCHEMBL5703569 | 0.75 | NR1D1 (0.53) | MAOBALDH1A1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL20135644 | 0.74 | MEN1 (0.45) | TSHRLMNARECQLMEN1KMT2A | |
| SCHEMBL20135643 | 0.74 | MEN1 (0.45) | TSHRLMNARECQLMEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0659178-A4 | CHIRAL QUINOLONE INTERMEDIATES. | ABBOTT LAB (US) | 1996-03-27 | — | — | EP | disclosed |
| EP-0659178-A1 | CHIRAL QUINOLONE INTERMEDIATES | ABBOTT LABORATORIES (US) | 1995-06-28 | — | — | EP | disclosed |
| WO-1994006766-A1 | CHIRAL QUINOLONE INTERMEDIATES | ABBOTT LABORATORIES (US) | 1994-03-31 | — | — | WO | disclosed |
| US-5252747-A | Chiral quinolone intermediates | ABBOTT LABORATORIES (US) | 1993-10-12 | — | — | US | disclosed |