Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.48 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.47 |
| ▸ | CDC7 | O00311 | 1/20 | 0.42 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15875591 | 0.77 | HSD11B1 (0.51) | HSD11B1P2RX7CDC7SLC9A1GRM2 | |
| SCHEMBL15883231 | 0.76 | HSD11B1 (0.49) | HSD11B1P2RX7HPGDSMN1; SMN2HDAC3 | |
| SCHEMBL4195851 | 0.75 | HSD11B1 (0.61) | HSD11B1P2RX7CDC7SLC9A1GRM2 | |
| SCHEMBL1371186 | 0.73 | KDM4E (0.54) | HSD11B1P2RX7CDC7SLC9A1GRM2 | |
| SCHEMBL28230792 | 0.73 | P2RX7 (0.50) | HSD11B1P2RX7CDC7SLC9A1GRM2 | |
| SCHEMBL11563985 | 0.73 | P2RX7 (0.50) | HSD11B1P2RX7CDC7SLC9A1GRM2 | |
| SCHEMBL15875415 | 0.72 | CYP11B1 (0.46) | HSD11B1KDM4EALDH1A1TSHRCYP1A2 | |
| SCHEMBL23336762 | 0.72 | HSD11B1 (0.55) | HSD11B1P2RX7CDC7HPGDALDH1A1 | |
| SCHEMBL2895467 | 0.71 | CDC7 (0.61) | HSD11B1P2RX7CDC7SLC9A1GRM2 | |
| SCHEMBL15874678 | 0.71 | HSD11B1 (0.65) | HSD11B1P2RX7CDC7SLC9A1GRM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2943494-B1 | PYRIDO- OR PYRROLO-FUSED PYRIMIDINE DERIVATIVES AS AUTOTAXIN INHIBITORS FOR TREATING PAIN | LILLY CO ELI (US) | 2017-02-22 | — | — | EP | disclosed |