Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | GAA | P10253 | 5/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 2/20 | 0.43 |
| ▸ | GRM6 | O15303 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1127045 | 0.87 | TSHR (0.68) | TSHRMAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL21484965 | 0.80 | TSHR (0.55) | TSHRMAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL1126753 | 0.78 | TSHR (0.53) | TSHRMAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL1127080 | 0.77 | TSHR (0.55) | TSHRMAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL1126743 | 0.76 | AR (0.49) | TSHRMAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL1126962 | 0.75 | TSHR (0.53) | TSHRMAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL1126966 | 0.75 | TSHR (0.53) | TSHRMAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL1991365 | 0.75 | TSHR (0.50) | TSHRMAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL1127099 | 0.73 | TSHR (0.57) | TSHRMAPTSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL1126643 | 0.73 | TSHR (0.54) | TSHRMAPTSMN1; SMN2RAB9ANPC1 |
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-113429396-A | Five-membered heteroaromatic ring derivative and preparation method and application thereof | 深圳市祥根生物医药有限公司 | 2021-09-24 | — | — | CN | disclosed |