Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.36 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.36 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.36 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | KDM5A | P29375 | 1/20 | 0.35 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | METAP2 | P50579 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17664001 | 0.90 | GPR52 (0.35) | FYNHSP90AB1MBOAT4KDM4EDAO | |
| SCHEMBL17664358 | 0.88 | HDAC3 (0.41) | HSP90AB1DAO | |
| SCHEMBL23716215 | 0.87 | MBOAT4 (0.37) | FYNHSP90AB1MBOAT4KDM4EDAO | |
| SCHEMBL23716265 | 0.85 | RXRA (0.39) | HSP90AB1MPOMBOAT4DAO | |
| SCHEMBL17663971 | 0.81 | HSP90AB1 (0.47) | HSP90AB1MBOAT4ALDH1A1KDM4E | |
| SCHEMBL17663857 | 0.81 | IDO1 (0.42) | HSP90AB1ALDH1A1HTT | |
| SCHEMBL23716203 | 0.80 | MBOAT4 (0.39) | HSP90AB1MBOAT4S1PR1S1PR3ALDH1A1 | |
| SCHEMBL17664376 | 0.77 | ALDH1A1 (0.43) | MBOAT4ALDH1A1HTTKDM4EMAPK14 | |
| SCHEMBL23716095 | 0.76 | GPR52 (0.34) | FYNKDM5AKDM5B | |
| SCHEMBL17663975 | 0.75 | RAB9A (0.48) | HSP90AB1MBOAT4KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3209732-B1 | SPHINGOSINE-1-PHOSPATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS | SCRIPPS RESEARCH INST (US) | 2021-08-04 | — | — | EP | disclosed |
| WO-2016053855-A1 | SPHINGOSINE-1-PHOSPATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2016-04-07 | — | — | WO | disclosed |