Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP3 | O14638 | 1/20 | 0.53 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.46 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.46 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL17707864 | 0.75 | NR1H4 (0.61) | RAB9AMAPTSMN1; SMN2HSD17B10L3MBTL1 | |
| SCHEMBL1435709 | 0.75 | ENPP3 (0.50) | ENPP3ENPP1RAB9AMAPTLMNA | |
| SCHEMBL3061817 | 0.74 | NR1H4 (0.64) | RAB9AMAPTSMN1; SMN2HSD17B10L3MBTL1 | |
| SCHEMBL3056578 | 0.73 | NR1H4 (0.74) | RAB9AMAPTLMNASMN1; SMN2HSD17B10 | |
| SCHEMBL197017 | 0.73 | LMNA (0.72) | ENPP3ENPP1RAB9AMAPTLMNA | |
| SCHEMBL4032011 | 0.72 | FFAR1 (0.70) | MAPT | |
| SCHEMBL2081304 | 0.72 | FFAR1 (0.57) | ENPP3ENPP1RAB9AMAPTLMNA | |
| SCHEMBL10128671 | 0.72 | LMNA (0.60) | ENPP3ENPP1RAB9AMAPTLMNA | |
| SCHEMBL27501768 | 0.72 | LTA4H (0.69) | ENPP3ENPP1RAB9AMAPTLMNA | |
| SCHEMBL3057378 | 0.71 | PPARD (0.58) | RAB9ASMN1; SMN2L3MBTL1NPC1MAOB |
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-104817553-B | The pyrimidinediamine class compound and its derivative and its medical usage of a kind of aromatic radical-heterocyclic substituted | 华东师范大学 | 2018-11-09 | — | — | CN | disclosed |