Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.47 |
| ▸ | ELOVL1 | Q9BW60 | 1/20 | 0.47 |
| ▸ | LSS | P48449 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NCF1 | P14598 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7374338 | 0.80 | ADORA2A (0.39) | P2RX7ADORA2AADORA1ELOVL1HSD17B10 | |
| SCHEMBL458507 | 0.74 | P2RX7 (0.53) | P2RX7ADORA2AADORA1ELOVL1LSS | |
| SCHEMBL9468809 | 0.71 | P2RX7 (0.55) | P2RX7ADORA2AADORA1ELOVL1LSS | |
| SCHEMBL6464483 | 0.70 | HDAC1 (0.55) | P2RX7ADORA2AADORA1ELOVL1LSS | |
| SCHEMBL18039129 | 0.69 | P2RX7 (0.53) | P2RX7ADORA2AADORA1ELOVL1LSS | |
| SCHEMBL1037429 | 0.69 | P2RX7 (0.53) | P2RX7ELOVL1LSSKDM4EHPGD | |
| SCHEMBL11605633 | 0.69 | P2RX7 (0.58) | P2RX7ADORA2AADORA1ELOVL1LSS | |
| SCHEMBL16797793 | 0.69 | P2RX7 (0.49) | P2RX7ADORA2AADORA1ELOVL1LSS | |
| SCHEMBL12146363 | 0.69 | P2RX7 (0.68) | P2RX7ADORA2AADORA1ELOVL1LSS | |
| SCHEMBL11915913 | 0.69 | P2RX7 (0.49) | P2RX7ADORA2AADORA1ELOVL1LSS |
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 |
|---|---|---|---|---|---|---|---|
| CN-105143206-B | Pyrimidine -2,4- diamine derivative for treating cancer | 托马斯·黑勒戴药物研究基金会 | 2019-01-15 | — | — | CN | disclosed |
| CN-105143206-A | Pyrimidine-2,4-diamine derivatives for treatment of cancer | THOMAS HELLEDAYS STIFTELSE F R MEDICINSK FORSKNING | 2015-12-09 | — | — | CN | disclosed |