Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2D | O15399 | 1/20 | 0.59 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.59 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.59 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | USP2 | O75604 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CASP1 | P29466 | 1/20 | 0.50 |
| ▸ | CASP7 | P55210 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 4/20 | 0.49 |
| ▸ | POLA1 | P09884 | 1/20 | 0.47 |
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL23640265 | 0.84 | HSP90AA1 (0.54) | HSD17B10KDM4EMEN1POLBCASP1 | |
| SCHEMBL18952912 | 0.80 | HSP90AA1 (0.56) | HSD17B10USP2HSP90AA1HSP90AB1HPGD | |
| SCHEMBL8118387 | 0.76 | MAOA (0.60) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B10 | |
| SCHEMBL29620342 | 0.75 | GRIN2D (1.00) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B10 | |
| SCHEMBL214909 | 0.75 | GRIN2D (1.00) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B10 | |
| SCHEMBL3624238 | 0.75 | ALDH1A1 (0.56) | KDM4EKMT2AHPGDTDP1KEAP1 | |
| SCHEMBL12125184 | 0.74 | GRIN2D (0.67) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B10 | |
| SCHEMBL19820038 | 0.74 | GRIN2D (0.71) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B10 | |
| SCHEMBL9324678 | 0.74 | GRIN2D (0.71) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B10 | |
| SCHEMBL8119201 | 0.74 | GRIN2D (0.56) | GRIN2DGRIN2AGRIN2BGRIN2CHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010003475-A2 | NOVEL PYRROLIDONE DERIVATIVES FOR USE AS METAP-2 INHIBITORS | MERCK PATENT GMBH (DE) | 2010-01-14 | — | — | WO | disclosed |