Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | CHKA | P35790 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MC4R | P32245 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30245819 | 1.00 | SIGMAR1 (0.63) | SIGMAR1KDM4EALDH1A1SMN1; SMN2CHKA | |
| SCHEMBL25256589 | 0.93 | SIGMAR1 (0.55) | SIGMAR1KDM4EALDH1A1SMN1; SMN2CHKA | |
| SCHEMBL30245119 | 0.93 | SIGMAR1 (0.55) | SIGMAR1KDM4EALDH1A1SMN1; SMN2CHKA | |
| SCHEMBL30245540 | 0.92 | KDM4E (0.57) | SIGMAR1KDM4EALDH1A1SMN1; SMN2CHKA | |
| SCHEMBL25251020 | 0.92 | KDM4E (0.63) | SIGMAR1KDM4EALDH1A1SMN1; SMN2GAA | |
| SCHEMBL30245578 | 0.92 | KDM4E (0.63) | SIGMAR1KDM4EALDH1A1SMN1; SMN2GAA | |
| SCHEMBL25248944 | 0.92 | KDM4E (0.57) | SIGMAR1KDM4EALDH1A1SMN1; SMN2CHKA | |
| SCHEMBL30245261 | 0.90 | SIGMAR1 (0.52) | SIGMAR1KDM4EALDH1A1SMN1; SMN2CHKA | |
| SCHEMBL30245251 | 0.90 | KDM4E (0.57) | SIGMAR1KDM4EALDH1A1SMN1; SMN2CHKA | |
| SCHEMBL25261366 | 0.90 | SIGMAR1 (0.59) | SIGMAR1KDM4EALDH1A1SMN1; SMN2GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023018472-A9 | AMINOARYL-INTEGRIN AGONISTS COMPOUNDS | TEXAS HEART INSTITUTE (US) | 2023-07-13 | — | — | WO | disclosed |