Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 9/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | AKT2 | P31751 | 1/20 | 0.37 |
| ▸ | GAB1 | Q13480 | 1/20 | 0.37 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CTSV | O60911 | 1/20 | 0.32 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | CTSK | P43235 | 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 | |
|---|---|---|---|---|
| SCHEMBL10162230 | 0.77 | NPC1 (0.45) | AKT1NPC1POLBMEN1KMT2A | |
| SCHEMBL19549074 | 0.73 | ALDH1A1 (0.59) | NPC1MEN1KMT2A | |
| SCHEMBL10131096 | 0.72 | MEN1 (0.39) | POLBMEN1TSHRKMT2ACTSV | |
| SCHEMBL3721048 | 0.72 | ALDH1A1 (0.47) | NPC1POLBKMT2A | |
| SCHEMBL2377189 | 0.71 | CA1 (0.37) | AKT1PDPK1ABCB11AKT2GAB1 | |
| SCHEMBL9616971 | 0.70 | KDM4E (0.56) | AKT1PDPK1ABCB11AKT2GAB1 | |
| SCHEMBL7146697 | 0.69 | FBP1 (0.47) | NPC1POLBMEN1TSHRKMT2A | |
| SCHEMBL2376439 | 0.69 | MMP12 (0.49) | TSHR | |
| SCHEMBL7566383 | 0.69 | KDM4E (0.42) | NPC1MEN1TSHRKMT2A | |
| SCHEMBL11238301 | 0.69 | PDPK1 (0.42) | PDPK1NPC1POLBMEN1KMT2A |
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-107001351-A | Derivative available for the treatment particularly yl acetamide of 2 (the base sulfanyl of 1,2,4 triazole 3) 1,3,4 thiadiazoles of N 2 of diabetes | 阿波格吕克斯有限公司 | 2017-08-01 | — | — | CN | disclosed |