Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHMT2 | P34897 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 5/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29496047 | 1.00 | SHMT2 (0.43) | SHMT2MAP4K4MAOBPIM1ALDH1A1 | |
| SCHEMBL29495968 | 0.86 | GAA (0.50) | SHMT2PIM1GAASMN1; SMN2 | |
| SCHEMBL29496103 | 0.84 | GAA (0.55) | SHMT2PIM1GAASMN1; SMN2 | |
| SCHEMBL28722024 | 0.84 | GAA (0.55) | SHMT2PIM1GAASMN1; SMN2 | |
| SCHEMBL29496154 | 0.75 | MAP3K12 (0.34) | SHMT2GAA | |
| SCHEMBL29495994 | 0.73 | GAA (0.49) | MAP4K4MAOBALDH1A1MAPTMAPK1 | |
| SCHEMBL28722001 | 0.73 | GAA (0.49) | MAP4K4MAOBALDH1A1MAPTMAPK1 | |
| SCHEMBL31195870 | 0.73 | ALDH1A1 (0.42) | MAP4K4MAOBPIM1ALDH1A1MAPT | |
| SCHEMBL22044690 | 0.70 | MAOB (0.41) | MAP4K4MAOBPIM1ALDH1A1MAPT | |
| SCHEMBL15834207 | 0.69 | GAA (0.72) | MAP4K4PIM1ALDH1A1MAPK1TDP1 |
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-114269730-A | 5-heteroaryl-pyridin-2-amine compounds as neuropeptide FF receptor antagonists | 多曼治疗学公司 | 2022-04-01 | — | — | CN | disclosed |