Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | KIT | P10721 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25262893 | 0.93 | KIT (0.43) | KITDRD2DRD4ABCB1HRH3 | |
| SCHEMBL30245496 | 0.93 | KIT (0.43) | KITDRD2DRD4ABCB1HRH3 | |
| SCHEMBL30245173 | 0.92 | MAPT (0.41) | ALDH1A1TSHRSMN1; SMN2NPSR1EPHX2 | |
| SCHEMBL30245483 | 0.91 | DRD2 (0.44) | ALDH1A1TSHRSMN1; SMN2NPSR1DRD2 | |
| SCHEMBL25298289 | 0.91 | DRD2 (0.44) | ALDH1A1TSHRSMN1; SMN2NPSR1DRD2 | |
| SCHEMBL25258582 | 0.91 | DRD2 (0.46) | ALDH1A1TSHRSMN1; SMN2NPSR1DRD2 | |
| SCHEMBL30245231 | 0.91 | DRD2 (0.46) | ALDH1A1TSHRSMN1; SMN2NPSR1DRD2 | |
| SCHEMBL30244897 | 0.88 | MAPT (0.40) | ALDH1A1TSHRSMN1; SMN2NPSR1EPHX2 | |
| SCHEMBL25259271 | 0.88 | KIT (0.42) | KITDRD2DRD4ABCB1 | |
| SCHEMBL25261840 | 0.88 | KIT (0.41) | ALDH1A1TSHRSMN1; SMN2KITDRD2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023018472-A9 | AMINOARYL-INTEGRIN AGONISTS COMPOUNDS | TEXAS HEART INSTITUTE (US) | 2023-07-13 | — | — | WO | claimed |
| WO-2023018472-A9 | AMINOARYL-INTEGRIN AGONISTS COMPOUNDS | TEXAS HEART INSTITUTE (US) | 2023-07-13 | — | — | WO | disclosed |