Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.41 |
| ▸ | NPC1 | O15118 | 6/20 | 0.41 |
| ▸ | RAB9A | P51151 | 6/20 | 0.41 |
| ▸ | TP53 | P04637 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PORCN | Q9H237 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18038393 | 0.72 | STIM1 (0.45) | SMN1; SMN2NPC1RAB9ATP53MAPT | |
| SCHEMBL22598030 | 0.69 | STIM1 (0.55) | SMN1; SMN2NPC1RAB9ATP53MAPT | |
| SCHEMBL1781223 | 0.66 | RAB9A (0.47) | SMN1; SMN2NPC1RAB9ATP53MAPT | |
| SCHEMBL16636856 | 0.66 | MAPT (0.45) | SMN1; SMN2NPC1RAB9ATP53MAPT | |
| SCHEMBL16636706 | 0.64 | MEN1 (0.47) | SMN1; SMN2NPC1RAB9ATP53MAPT | |
| SCHEMBL18132538 | 0.64 | CYP1A2 (0.63) | NPC1RAB9AMAPTALDH1A1MEN1 | |
| SCHEMBL4290305 | 0.64 | ADORA2A (0.74) | SMN1; SMN2NPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL6810824 | 0.62 | KMT2A (0.52) | SMN1; SMN2NPC1RAB9ATP53MAPT | |
| SCHEMBL11912014 | 0.62 | KMT2A (0.77) | SMN1; SMN2MAPTALDH1A1MCL1TDP1 | |
| SCHEMBL419202 | 0.62 | CYP1A2 (0.71) | SMN1; SMN2NPC1RAB9AALDH1A1LMNA |
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-2021236820-A1 | METHODS AND COMPOSITIONS FOR TREATING ACUTE KIDNEY INJURY | CALCIMEDICA, INC. (US) | 2021-11-25 | — | — | WO | disclosed |