Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 8/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11076676 | 0.81 | HSD11B1 (0.54) | HSD11B1EPHX2L3MBTL1NPC1RAB9A | |
| SCHEMBL2093408 | 0.80 | HSD11B1 (0.44) | HSD11B1EPHX2L3MBTL1ALDH1A1 | |
| SCHEMBL24105897 | 0.79 | HSD11B1 (0.42) | HSD11B1EPHX2L3MBTL1NPC1RAB9A | |
| SCHEMBL13609189 | 0.76 | KMT2A (0.47) | HSD11B1EPHX2L3MBTL1NPC1RAB9A | |
| SCHEMBL27643099 | 0.75 | ALDH1A1 (0.43) | HSD11B1EPHX2L3MBTL1NPC1RAB9A | |
| SCHEMBL8556476 | 0.74 | HSD11B1 (0.43) | HSD11B1EPHX2L3MBTL1NPC1RAB9A | |
| SCHEMBL10106984 | 0.71 | CYP2C9 (0.49) | FUCA1ALDH1A1 | |
| SCHEMBL21376363 | 0.70 | CYP2C9 (0.56) | HSD11B1EPHX2L3MBTL1ALDH1A1 | |
| SCHEMBL1901026 | 0.70 | FUCA1 (0.39) | FUCA1ALDH1A1 | |
| SCHEMBL15932511 | 0.70 | CACNA1H (0.45) | FUCA1 |
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-2019178248-A1 | INHIBITORS OF INTEGRIN ALPHA 2 BETA 1 AND METHODS OF USE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2019-09-19 | — | — | WO | disclosed |