Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 10/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | F13A1 | P00488 | 1/20 | 0.42 |
| ▸ | QPCT | Q16769 | 1/20 | 0.41 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 7/20 | 0.41 |
| ▸ | ACACB | O00763 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13394010 | 0.82 | NTRK1 (0.42) | MTNR1AL3MBTL1 | |
| SCHEMBL18381380 | 0.81 | TAAR1 (0.38) | MTNR1AMTNR1BALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL1680574 | 0.76 | — | — | |
| SCHEMBL19051518 | 0.75 | LMNA (0.47) | ALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL3476547 | 0.73 | CYP1A2 (0.31) | — | |
| SCHEMBL28855095 | 0.72 | SLC6A2 (0.36) | ACACBL3MBTL1 | |
| SCHEMBL27811865 | 0.72 | TSHR (0.40) | KDM4EALDH1A1SMN1; SMN2LMNAMAPT | |
| SCHEMBL13616184 | 0.72 | CDK2 (0.48) | MTNR1AKDM4EF13A1QPCTQPCTL | |
| SCHEMBL29086344 | 0.72 | CYP1B1 (0.32) | — | |
| SCHEMBL4706813 | 0.72 | — | — |
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-2020198583-A1 | BICYCLIC JAK INHIBITORS AND USES THEREOF | INSILICO MEDICINE IP LIMITED (CN) | 2020-10-01 | — | — | WO | disclosed |