Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 3/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | VNN1 | O95497 | 1/20 | 0.33 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.31 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Thioglycolic Acid SCHEMBL28554861 | 0.98 | P2RX7 (0.40) | P2RX7CYP1A2AHRCES1LMNA | |
| SCHEMBL29473254 | 0.79 | — | — | |
| SCHEMBL28259 | 0.79 | — | — | |
| Ammonia Solution, Strong SCHEMBL1056214 | 0.77 | — | — | |
| SCHEMBL29077066 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL14246931 | 0.77 | — | — | |
| SCHEMBL30785544 | 0.77 | — | — | |
| SCHEMBL28566473 | 0.76 | CTDSP1 (0.36) | P2RX7CYP1A2AHRLMNASMN1; SMN2 | |
| SCHEMBL28566153 | 0.75 | CTDSP1 (0.39) | P2RX7CYP1A2AHRCES1CTDSP1 | |
| Pyridine SCHEMBL4038507 | 0.74 | TDP1 (0.41) | P2RX7CYP1A2AHRLMNASMN1; SMN2 |
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-108069940-B | Thioacetic acid compounds, compositions and uses thereof | 广东赛烽医药科技有限公司 | 2021-04-30 | — | — | CN | disclosed |