Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | HTR1D | P28221 | 1/20 | 0.46 |
| ▸ | HTR1B | P28222 | 1/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | TACR2 | P21452 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SHBG | P04278 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8602835 | 1.00 | HTR1A (0.46) | HTR1AHTR1DHTR1BGPR84ESR1 | |
| SCHEMBL28523093 | 0.78 | BACE1 (0.48) | HTR1AHTR1DHTR1BGPR84ESR1 | |
| SCHEMBL8600658 | 0.77 | HTR1B (0.48) | HTR1AHTR1DHTR1BKDM4ETP53 | |
| SCHEMBL9707132 | 0.76 | KIF11 (0.51) | HTR1AHTR1DHTR1BESR1ADRA2A | |
| SCHEMBL9707129 | 0.76 | KIF11 (0.51) | HTR1AHTR1DHTR1BESR1ADRA2A | |
| SCHEMBL28298246 | 0.76 | KIF11 (0.51) | HTR1AHTR1DHTR1BESR1ADRA2A | |
| SCHEMBL9707156 | 0.76 | KIF11 (0.51) | HTR1AHTR1DHTR1BESR1ADRA2A | |
| SCHEMBL9707151 | 0.76 | KIF11 (0.51) | HTR1AHTR1DHTR1BESR1ADRA2A | |
| SCHEMBL564963 | 0.75 | HDAC1 (0.56) | HTR1AHTR1DHTR1BGPR84ESR1 | |
| SCHEMBL8603411 | 0.74 | RHEB (0.42) | ALDH1A1HSD17B10 |
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-5773449-A | BACTERICIDES FOR HELICOBACTER | ZENYAKU KOGYO KABUSHIKI KAISHA (JP) | 1998-06-30 | — | — | US | disclosed |
| EP-0786454-A1 | THIOQUINOLONE DERIVATIVE | ZENYAKU KOGYO KABUSHIKIKAISHA (JP) | 1997-07-30 | — | — | EP | disclosed |