Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1669584 | 1.00 | TSHR (0.48) | TSHRALDH1A1KMT2AMEN1RAB9A | |
| SCHEMBL31351961 | 0.84 | TSHR (0.47) | TSHRALDH1A1KMT2AMEN1RAB9A | |
| SCHEMBL7844021 | 0.84 | TSHR (0.47) | TSHRALDH1A1KMT2AMEN1RAB9A | |
| SCHEMBL2327456 | 0.84 | TSHR (0.47) | TSHRALDH1A1KMT2AMEN1RAB9A | |
| SCHEMBL20503292 | 0.83 | TSHR (0.55) | TSHRALDH1A1RAB9ANPC1MAPT | |
| SCHEMBL23143261 | 0.83 | TSHR (0.46) | TSHRALDH1A1KMT2AMEN1RAB9A | |
| SCHEMBL2217314 | 0.83 | ALDH1A1 (0.49) | TSHRALDH1A1KMT2AMEN1RAB9A | |
| SCHEMBL8682515 | 0.83 | HSP90AA1 (0.49) | TSHRALDH1A1KMT2AMEN1RAB9A | |
| SCHEMBL31148366 | 0.83 | TSHR (0.46) | TSHRALDH1A1KMT2AMEN1RAB9A | |
| SCHEMBL1964549 | 0.83 | RAB9A (0.52) | TSHRALDH1A1KMT2AMEN1RAB9A |
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-115052873-A | Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors | 勃林格殷格翰国际有限公司 | 2022-09-13 | — | — | CN | disclosed |