Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | HSD17B14 | Q9BPX1 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6824690 | 0.95 | IKBKB (0.35) | IKBKBHSD17B14KMT2AALDH1A1NPC1 | |
| SCHEMBL6826558 | 0.95 | HSD17B14 (0.32) | IKBKBHSD17B14KMT2ANPC1MAPK1 | |
| SCHEMBL6824183 | 0.92 | MAPK14 (0.35) | HSD17B14KMT2AALDH1A1MAPTCDK1 | |
| SCHEMBL6920876 | 0.92 | KMT2A (0.33) | HSD17B14KMT2AALDH1A1NPC1MAPK1 | |
| SCHEMBL6921921 | 0.92 | CDK1 (0.34) | HSD17B14KMT2AALDH1A1NPC1MAPK1 | |
| SCHEMBL6824066 | 0.91 | HSD17B14 (0.32) | HSD17B14KMT2ACDK1CDK2MEN1 | |
| SCHEMBL6823654 | 0.89 | MAPK14 (0.34) | HSD17B14KMT2AALDH1A1NPC1MAPK1 | |
| SCHEMBL6821385 | 0.89 | MAPK14 (0.34) | CDK1CDK2KDR | |
| SCHEMBL6823887 | 0.86 | CDK2 (0.37) | HSD17B14KMT2AALDH1A1LMNAGAA | |
| SCHEMBL6824190 | 0.85 | MAPK14 (0.43) | ALDH1A1GAACDK1CDK2ADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004080979-A1 | NOVEL 3-(2-AMINO-4-PYRIMIDINYL)-4-HYDROXYPHENYL KETONE DERIVATIVES | LG LIFE SCIENCES LTD. (KR) | 2004-09-23 | — | — | WO | claimed |
| WO-2004080979-A1 | NOVEL 3-(2-AMINO-4-PYRIMIDINYL)-4-HYDROXYPHENYL KETONE DERIVATIVES | LG LIFE SCIENCES LTD. (KR) | 2004-09-23 | — | — | WO | disclosed |