Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | WDR5 | P61964 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1614907 | 0.73 | — | — | |
| SCHEMBL83814 | 0.71 | TEAD4 (0.74) | ACHETDP1CYP3A4TSHRTEAD4 | |
| SCHEMBL686365 | 0.71 | ACHE (0.61) | ACHETDP1CYP3A4TSHRTEAD4 | |
| SCHEMBL83863 | 0.71 | TEAD4 (0.74) | ACHETDP1CYP3A4TSHRTEAD4 | |
| SCHEMBL95343 | 0.71 | TEAD4 (0.74) | ACHETDP1CYP3A4TSHRTEAD4 | |
| SCHEMBL13925529 | 0.69 | — | — | |
| SCHEMBL19182839 | 0.69 | ACHE (1.00) | ACHETDP1CYP3A4ALDH1A1MAPT | |
| SCHEMBL29377968 | 0.69 | TEAD4 (0.70) | ACHETDP1CYP3A4TSHRTEAD4 | |
| Phosphine SCHEMBL22361928 | 0.69 | TEAD4 (0.70) | ACHETDP1CYP3A4TSHRTEAD4 | |
| SCHEMBL12464 | 0.69 | — | — |
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-105924632-B | Method for preparing sulfhydryl terminated polyester by using micro-reaction device | 南京工业大学 | 2020-06-26 | — | — | CN | disclosed |