Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 13/20 | 0.50 |
| ▸ | HTR2A | P28223 | 13/20 | 0.50 |
| ▸ | HTR1A | P08908 | 7/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.50 |
| ▸ | HTR2C | P28335 | 3/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.50 |
| ▸ | HRH1 | P35367 | 3/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.50 |
| ▸ | DRD1 | P21728 | 2/20 | 0.50 |
| ▸ | DRD4 | P21917 | 2/20 | 0.50 |
| ▸ | DRD5 | P21918 | 2/20 | 0.50 |
| ▸ | HTR1D | P28221 | 2/20 | 0.50 |
| ▸ | HTR1B | P28222 | 2/20 | 0.50 |
| ▸ | HTR7 | P34969 | 2/20 | 0.50 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.50 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.50 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10551137 | 0.82 | DRD2 (0.52) | DRD2HTR2AHTR1AKCNH2HTR2C | |
| SCHEMBL10551226 | 0.82 | DRD2 (0.52) | DRD2HTR2AHTR1AKCNH2HTR2C | |
| SCHEMBL9535893 | 0.82 | HTR1A (0.53) | DRD2HTR2AHTR1AKCNH2HTR2C | |
| SCHEMBL9564863 | 0.80 | NR4A2 (0.48) | KCNH2 | |
| SCHEMBL9564878 | 0.78 | HRH1 (0.49) | DRD2HTR2AHTR1AKCNH2HTR2C | |
| SCHEMBL9564783 | 0.78 | CYP3A4 (0.39) | KCNH2HRH1CYP2D6CHRM1TSHR | |
| SCHEMBL9564927 | 0.73 | P2RX7 (0.44) | DRD2HTR2AHTR1AKCNH2HTR2C | |
| SCHEMBL10549840 | 0.73 | SLC6A9 (0.47) | DRD2HTR2AHTR1AKCNH2HTR2C | |
| SCHEMBL9564914 | 0.71 | CYP3A4 (0.47) | DRD2HTR2AHTR1AHTR2CADRA1A | |
| Bromide SCHEMBL9564766 | 0.71 | KCNH2 (0.42) | DRD2HTR2AHTR1AKCNH2HRH1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5258380-A | Antiallergens, antihistamines | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-11-02 | — | — | US | disclosed |
| EP-0206415-B1 | (4-PIPERIDINYLMETHYL AND -HETERO)PURINES | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-01-27 | — | — | EP | disclosed |
| US-5041448-A | Antiallergens | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-08-20 | — | — | US | disclosed |
| EP-0206415-A2 | (4-Piperidinylmethyl and -hetero)purines | JANSSEN PHARMACEUTICA N.V. (BE) | 1986-12-30 | — | — | EP | disclosed |