Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 6/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL31503973 | 0.78 | TSHR (0.50) | TSHRSMN1; SMN2ALDH1A1POLBHTT | |
| SCHEMBL30305936 | 0.71 | TSHR (0.44) | TSHRSMN1; SMN2ALDH1A1POLBHTT | |
| SCHEMBL7394679 | 0.70 | DPP4 (0.49) | TSHRSMN1; SMN2ALDH1A1POLBHTT | |
| SCHEMBL7527896 | 0.70 | TSHR (0.35) | TSHRSMN1; SMN2ALDH1A1POLBHTT | |
| SCHEMBL10824399 | 0.70 | ALDH1A1 (0.42) | TSHRSMN1; SMN2ALDH1A1POLBHTT | |
| SCHEMBL4283831 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL27665005 | 0.69 | TSHR (0.34) | TSHRSMN1; SMN2ALDH1A1POLBHTT | |
| Hydrochloric Acid SCHEMBL27599189 | 0.69 | TSHR (0.34) | TSHRSMN1; SMN2ALDH1A1POLBHTT | |
| SCHEMBL6891992 | 0.68 | MAPT (0.41) | TSHRSMN1; SMN2ALDH1A1POLBHTT | |
| SCHEMBL10995254 | 0.67 | TSHR (0.56) | TSHRSMN1; SMN2ALDH1A1POLBHTT |
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-116075516-A | Benzodiazepine derivatives useful for the treatment of respiratory syncytial virus infection | 辉瑞大药厂 | 2023-05-05 | — | — | CN | disclosed |