Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 9/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 5/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TYR | P14679 | 1/20 | 0.39 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL169165 | 0.90 | GSK3B (0.47) | GSK3BPTPN1THRATHRBCYP2J2 | |
| SCHEMBL86418 | 0.82 | KMT2A (0.55) | NPC1RAB9AMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL28944713 | 0.82 | ALDH1A1 (0.41) | NPC1RAB9AMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL23929839 | 0.82 | GSK3B (0.57) | GSK3BPTPN1RAB9AMAPTTHRA | |
| SCHEMBL1640478 | 0.81 | L3MBTL1 (0.64) | NPC1RAB9ASMN1; SMN2ALDH1A1ESR1 | |
| SCHEMBL5742746 | 0.81 | RAB9A (0.41) | NPC1RAB9AMAPTSMN1; SMN2THRA | |
| SCHEMBL4668894 | 0.79 | ALDH1A1 (0.45) | NPC1RAB9AMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL30267152 | 0.78 | L3MBTL1 (0.58) | GSK3BRAB9AMAPTALDH1A1L3MBTL1 | |
| SCHEMBL15896576 | 0.78 | NPC1 (0.41) | NPC1RAB9AMAPTSMN1; SMN2THRA | |
| SCHEMBL8501592 | 0.77 | THRA (0.57) | THRATHRB |
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-2012027965-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-08 | — | — | WO | disclosed |
| WO-2012027965-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-08 | — | — | WO | disclosed |