Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 11/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31318 | 0.84 | GSK3B (0.50) | NPSR1MAOAMAOBCDC25BTSHR | |
| Phthalimide SCHEMBL25328900 | 0.78 | GSK3B (0.62) | NPSR1MAOAMAOBALDH1A1GSK3B | |
| Phthalimide SCHEMBL30718274 | 0.78 | GSK3B (0.62) | NPSR1MAOAMAOBALDH1A1GSK3B | |
| Phthalimide SCHEMBL29391542 | 0.78 | GSK3B (0.62) | NPSR1MAOAMAOBALDH1A1GSK3B | |
| Trifluoroacetic Acid SCHEMBL30343227 | 0.71 | L3MBTL1 (0.42) | SLC22A12ALDH1A1GSK3BCDC7MAP4K4 | |
| Trifluoroacetic Acid SCHEMBL22980504 | 0.68 | KDM1A (0.34) | HRH4HRH3 | |
| Trifluoroacetic Acid SCHEMBL5015284 | 0.68 | TDP1 (0.56) | SLC22A12ALDH1A1CDC7L3MBTL1MAPT | |
| Isoquinoline SCHEMBL4339110 | 0.67 | IMPDH2 (0.46) | SLC22A12ROCK2L3MBTL1CYP3A4 | |
| Trifluoroacetic Acid SCHEMBL30967251 | 0.67 | HRH4 (0.43) | TSHRALDH1A1L3MBTL1TP53CYP3A4 | |
| Isoquinoline SCHEMBL4339108 | 0.67 | IMPDH2 (0.46) | SLC22A12ROCK2L3MBTL1CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1458723-A4 | FUSED HETEROCYCLIC SUCCINIMIDECOMPOUNDS AND ANALOGS THEREOF, MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION | BRISTOL MYERS SQUIBB CO (US) | 2005-12-21 | — | — | EP | disclosed |
| EP-1458723-A1 | FUSED HETEROCYCLIC SUCCINIMIDECOMPOUNDS AND ANALOGS THEREOF, MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION | Bristols-Myers Squibb Company (US) | 2004-09-22 | — | — | EP | disclosed |
| WO-2003062241-A1 | FUSED HETEROCYCLIC SUCCINIMIDECOMPOUNDS AND ANALOGS THEREOF, MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-07-31 | — | — | WO | disclosed |