Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 13/20 | 0.73 |
| ▸ | HTR1D | P28221 | 10/20 | 0.73 |
| ▸ | HTR1B | P28222 | 10/20 | 0.73 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.50 |
| ▸ | HTR3A | P46098 | 1/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.43 |
| ▸ | DRD1 | P21728 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | HRH2 | P25021 | 2/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6000211 | 0.87 | HTR1A (0.75) | HTR1AHTR1DHTR1BSLC6A9KCNH2 | |
| SCHEMBL9062634 | 0.81 | HTR1A (0.81) | HTR1AHTR1DHTR1BSLC6A9KCNH2 | |
| SCHEMBL6313399 | 0.80 | HTR1A (0.69) | HTR1AHTR1DHTR1BSLC6A9KCNH2 | |
| SCHEMBL6314991 | 0.80 | HTR1A (0.64) | HTR1AHTR1DHTR1BSLC6A9KCNH2 | |
| SCHEMBL6312894 | 0.79 | HTR1A (0.75) | HTR1AHTR1DHTR1BSLC6A9KCNH2 | |
| SCHEMBL6313298 | 0.79 | HTR1A (0.63) | HTR1AHTR1DHTR1BHTR3AADRB2 | |
| SCHEMBL6307480 | 0.78 | HTR1A (0.62) | HTR1AHTR1DHTR1BSLC6A9KCNH2 | |
| SCHEMBL9058520 | 0.78 | HTR1A (0.79) | HTR1AHTR1DHTR1BSLC6A9KCNH2 | |
| SCHEMBL9058908 | 0.78 | HTR1A (0.81) | HTR1AHTR1DHTR1BSLC6A9KCNH2 | |
| SCHEMBL9054738 | 0.78 | HTR1A (0.81) | HTR1AHTR1DHTR1BSLC6A9KCNH2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5821245-A | Use of naphthalene derivatives in treating lung carcinoma | PFIZER INC. (US) | 1998-10-13 | — | — | US | disclosed |