Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3901555 | 0.78 | ALDH1A1 (0.40) | ALDH1A1CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL3901551 | 0.78 | ALDH1A1 (0.40) | ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL7381251 | 0.71 | ALDH1A1 (0.35) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL7385610 | 0.70 | ALDH1A1 (0.37) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| Bromide SCHEMBL7381549 | 0.70 | ALDH1A1 (0.34) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| Bromide SCHEMBL7382414 | 0.70 | ALDH1A1 (0.36) | ALDH1A1CYP1A2CYP2C19L3MBTL1POLB | |
| Bromide SCHEMBL7382412 | 0.70 | ALDH1A1 (0.36) | ALDH1A1CYP1A2CYP2C19L3MBTL1POLB | |
| SCHEMBL7381653 | 0.68 | ALDH1A1 (0.33) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL7381886 | 0.67 | CNR1 (0.33) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| Bromide SCHEMBL7384264 | 0.67 | ALDH1A1 (0.32) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A |
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-105130923-A | Preparation method of polysubstituted 2-iminothiazole compound | UNIV ZHEJIANG TECHNOLOGY | 2015-12-09 | — | — | CN | disclosed |