Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | APOBEC3A | P31941 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.38 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23728529 | 0.85 | APOBEC3A (0.45) | HPGDALDH1A1APOBEC3AL3MBTL1NPC1 | |
| SCHEMBL18049709 | 0.85 | HPGD (0.45) | HPGDALDH1A1APOBEC3AL3MBTL1NPC1 | |
| SCHEMBL31061409 | 0.82 | IRAK4 (0.40) | HPGDIRAK4APOBEC3ASMPD3NTRK1 | |
| SCHEMBL17657041 | 0.82 | PIK3CG (0.45) | IRAK4SMPD3PIK3CDPIK3R1PIK3CG | |
| SCHEMBL22102607 | 0.81 | NTRK1 (0.51) | HPGDIRAK4ALDH1A1APOBEC3ANPC1 | |
| SCHEMBL29359724 | 0.78 | HTR6 (0.49) | HPGDIRAK4NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29788579 | 0.77 | KCNQ3 (0.39) | HPGDIRAK4ALDH1A1APOBEC3ASMPD3 | |
| SCHEMBL30267400 | 0.77 | IRAK4 (0.41) | HPGDIRAK4ALDH1A1APOBEC3ANTRK1 | |
| SCHEMBL23728612 | 0.77 | HPGD (0.44) | HPGDALDH1A1APOBEC3ANPC1RAB9A | |
| SCHEMBL22102600 | 0.76 | HTR6 (0.41) | HPGDIRAK4PIK3CDPIK3CG |
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-2012034095-A1 | COMPOUNDS AND COMPOSITIONS AS TRK INHIBITORS | IRM LLC (BM) | 2012-03-15 | — | — | WO | disclosed |