Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 3/20 | 0.71 |
| ▸ | BCHE | P06276 | 1/20 | 0.57 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.53 |
| ▸ | DDX3X | O00571 | 3/20 | 0.49 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.48 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.48 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13527214 | 0.95 | MIF (0.67) | MIFBCHESPHK1DDX3XS1PR1 | |
| SCHEMBL13527245 | 0.93 | MIF (0.69) | MIFBCHESPHK1DDX3XS1PR1 | |
| SCHEMBL15060983 | 0.93 | MIF (0.68) | MIFBCHESPHK1DDX3XS1PR1 | |
| SCHEMBL15060974 | 0.92 | MIF (0.71) | MIFBCHESPHK1DDX3XS1PR1 | |
| SCHEMBL13527307 | 0.88 | MIF (0.64) | MIFBCHESPHK1S1PR1NOTUM | |
| SCHEMBL15060865 | 0.86 | MIF (0.66) | MIFBCHES1PR1NOTUMP2RX7 | |
| SCHEMBL1313081 | 0.85 | MIF (0.68) | MIFBCHESPHK1DDX3XCYP19A1 | |
| SCHEMBL15923549 | 0.85 | MIF (0.97) | MIFBCHESPHK1DDX3XCYP19A1 | |
| SCHEMBL18031111 | 0.85 | MIF (0.97) | MIFBCHESPHK1DDX3XCYP19A1 | |
| SCHEMBL13527045 | 0.83 | MIF (0.62) | MIFBCHESPHK1DDX3XS1PR1 |
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-2014118556-A2 | SELECTIVE INHIBITORS AND ALLOSTERIC ACTIVATORS OF SPHINGOSINE KINASE | RESEARCH FOUNDATION OF THE CITY UNIVERSITY OF NEW YORK (US) | 2014-08-07 | — | — | WO | disclosed |
| WO-2014118556-A2 | SELECTIVE INHIBITORS AND ALLOSTERIC ACTIVATORS OF SPHINGOSINE KINASE | RESEARCH FOUNDATION OF THE CITY UNIVERSITY OF NEW YORK (US) | 2014-08-07 | — | — | WO | disclosed |