Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.52 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.51 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.50 |
| ▸ | AURKA | O14965 | 1/20 | 0.50 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.50 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL15757669 | 0.84 | DYRK1A (0.67) | HPGDTSHRTP53MAPTALOX15 | |
| SCHEMBL31295947 | 0.82 | DYRK1A (0.69) | HPGDTSHRADORA1ADORA2AADORA2B | |
| SCHEMBL15756951 | 0.82 | NUDT1 (0.56) | HPGDTSHRMAPTKMT2AADORA1 | |
| SCHEMBL15757289 | 0.81 | NUDT1 (0.58) | ADORA1ADORA2ANUDT1AURKAPDPK1 | |
| SCHEMBL5751719 | 0.81 | HSP90AA1 (0.54) | HPGDTSHRADORA1ADORA2AADORA2B | |
| SCHEMBL17407824 | 0.80 | HRH4 (0.68) | HPGDTSHRTP53MAPTALOX15 | |
| SCHEMBL28822368 | 0.79 | NUDT1 (0.54) | MAPTKMT2AADORA1ADORA2AADORA2B | |
| SCHEMBL1644371 | 0.79 | HSP90AA1 (0.61) | HPGDTSHRADORA1ADORA2AADORA2B | |
| SCHEMBL31295981 | 0.79 | PTGDR (0.69) | HPGDTSHRTP53MAPTALOX15 | |
| SCHEMBL14748394 | 0.79 | TP53 (0.52) | HPGDTSHRTP53MAPTALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105143206-A | Pyrimidine-2,4-diamine derivatives for treatment of cancer | THOMAS HELLEDAYS STIFTELSE F R MEDICINSK FORSKNING | 2015-12-09 | — | — | CN | disclosed |