Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | TAS2R38 | P59533 | 2/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.38 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8631208 | 0.76 | NPSR1 (0.46) | NPSR1TSHRIDO1CA12CA9 | |
| SCHEMBL8632209 | 0.76 | NPSR1 (0.50) | NPSR1TSHRIDO1CA12CA9 | |
| SCHEMBL1491874 | 0.72 | NPSR1 (0.56) | NPSR1TSHRCA12CA9HSD17B10 | |
| SCHEMBL7076211 | 0.70 | IDO1 (0.43) | NPSR1TSHRIDO1CA12CA9 | |
| SCHEMBL195068 | 0.70 | CA9 (0.52) | NPSR1TSHRIDO1CA12CA9 | |
| SCHEMBL8081387 | 0.70 | CA9 (0.52) | NPSR1TSHRIDO1CA12CA9 | |
| SCHEMBL6831562 | 0.70 | ALDH1A1 (0.44) | NPSR1TSHRIDO1CA12CA9 | |
| SCHEMBL9328080 | 0.68 | CA9 (0.50) | NPSR1TSHRIDO1CA12CA9 | |
| SCHEMBL17319264 | 0.67 | HPGD (0.53) | NPSR1CA12CA9HPGDTDP1 | |
| SCHEMBL6831560 | 0.67 | CA9 (0.48) | NPSR1TSHRIDO1CA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0850248-A1 | COMPOSITIONS AND METHODS FOR THE SYNTHESIS OF ORGANOPHOSPHORUS DERIVATIVES | POLSKA AKADEMIA NAUK CENTRUM BADAN MOLEKULARNYCH I MAKROMOLEKULARNYCH (PL) | 1998-07-01 | — | — | EP | disclosed |
| WO-1997009340-A1 | COMPOSITIONS AND METHODS FOR THE SYNTHESIS OF ORGANOPHOSPHORUS DERIVATIVES | POLSKA AKADEMIA NAUK CENTRUM BADAN MOLEKULARNYCH I MAKROMOLEKULARNYCH (PL) | 1997-03-13 | — | — | WO | disclosed |