Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 11/20 | 0.55 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.47 |
| ▸ | S1PR3 | Q99500 | 6/20 | 0.44 |
| ▸ | ESR1 | P03372 | 3/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.43 |
| ▸ | ESRRB | O95718 | 1/20 | 0.43 |
| ▸ | ESRRA | P11474 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.41 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.41 |
| ▸ | USP7 | Q93009 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28025221 | 0.98 | S1PR1 (0.57) | S1PR1HSD17B1HSD17B2S1PR3ESR1 | |
| SCHEMBL9195597 | 0.86 | S1PR1 (0.58) | S1PR1HSD17B1HSD17B2S1PR3ESR1 | |
| SCHEMBL28025731 | 0.82 | S1PR1 (0.51) | S1PR1HSD17B1HSD17B2S1PR3ESR1 | |
| SCHEMBL5638588 | 0.82 | HSD17B1 (0.47) | S1PR1HSD17B1HSD17B2ESR1ESR2 | |
| SCHEMBL2056285 | 0.82 | S1PR1 (0.51) | S1PR1S1PR3ALDH1A1MAPTHSD17B10 | |
| SCHEMBL28025184 | 0.82 | S1PR1 (0.51) | S1PR1S1PR3POLBMAPTADRB2 | |
| SCHEMBL9880273 | 0.81 | S1PR1 (0.50) | S1PR1S1PR3ADRB2ADRB1ADRB3 | |
| SCHEMBL1125388 | 0.78 | KMT2A (0.47) | HSD17B1HSD17B2ESR1ESR2ALDH1A1 | |
| Propionic Acid SCHEMBL10435684 | 0.77 | S1PR1 (0.50) | S1PR1S1PR3ALDH1A1HPGD | |
| SCHEMBL24415640 | 0.76 | ENPP3 (0.69) | HSD17B1HSD17B2ALDH1A1POLBMAPT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1037268-C | Antipicornaviral pyridazinamines | JANSSEM PHARMACEUTICA N V (BE) | 1998-02-04 | — | — | CN | disclosed |
| EP-0435381-B1 | Antipicornaviral pyridazinamines | JANSSEN PHARMACEUTICA NV (BE) | 1995-11-02 | — | — | EP | disclosed |
| US-5196535-A | Viricides | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-03-23 | — | — | US | disclosed |
| US-5100893-A | Viricides, effective against picorna virus, durability | JANSSEN PHARMACEUTICA N.V. (BE) | 1992-03-31 | — | — | US | disclosed |
| CN-1052857-A | The preparation method of the pyridazine amine that antipicornaviral is used | JANSSEN PHARMACEUTICA NV (BE) | 1991-07-10 | — | — | CN | disclosed |
| EP-0435381-A1 | Antipicornaviral pyridazinamines | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-07-03 | — | — | EP | disclosed |