Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 5/20 | 0.35 |
| ▸ | TNF | P01375 | 1/20 | 0.35 |
| ▸ | IL6 | P05231 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 3/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21376359 | 0.80 | PARP1 (0.39) | TDP1ALDH1A1PARP1 | |
| SCHEMBL6930689 | 0.78 | MAPT (0.38) | PIM1PIM3NFKB1MEN1LMNA | |
| SCHEMBL16585544 | 0.77 | KIF11 (0.33) | PIM1PIM3ALDH1A1TSHRERN1 | |
| SCHEMBL735425 | 0.76 | ALDH1A1 (0.43) | PIM1PIM3NFKB1MEN1LMNA | |
| SCHEMBL28057801 | 0.76 | ERN1 (0.52) | MEN1LMNATHRBBLMKMT2A | |
| SCHEMBL6853771 | 0.75 | NFKB1 (0.44) | PIM1PIM3NFKB1MEN1LMNA | |
| SCHEMBL29417728 | 0.74 | NFKB1 (0.57) | PIM1PIM3NFKB1MEN1LMNA | |
| SCHEMBL67207 | 0.74 | NFKB1 (0.57) | PIM1PIM3NFKB1MEN1LMNA | |
| SCHEMBL1989550 | 0.73 | AR (0.44) | TDP1ALDH1A1PARP1 | |
| SCHEMBL1600817 | 0.73 | PIM1 (0.43) | PIM1PIM3NFKB1MEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5026863-A | Medicinal products in racemic or enantiomorph form; calcium channel blockers. hypotensive agents, cardiovascular disorders | ADIR ET COMPAGNIE (FR) | 1991-06-25 | — | — | US | disclosed |
| US-4983740-A | Multistep; from 2- 2-/2-chloroethoxy/ethoxy!ethanol and potassium phthalimide | ADIR ET COMPAGNIE (FR) | 1991-01-08 | — | — | US | disclosed |
| US-4870091-A | CALCIUM CHANNEL BLOCKERS | ADIR ET CIE (FR) | 1989-09-26 | — | — | US | disclosed |