Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL29533957 | 0.87 | GAA (0.39) | ALDH1A1TSHRPOLBGAACYP3A4 | |
| SCHEMBL9461450 | 0.85 | ALDH1A1 (0.54) | ALDH1A1TSHRPOLBGAACYP3A4 | |
| SCHEMBL14561060 | 0.85 | POLB (0.41) | TSHRPOLBGAACYP3A4CYP2C9 | |
| SCHEMBL11690303 | 0.84 | ALDH1A1 (0.53) | ALDH1A1TSHRPOLBGAACYP3A4 | |
| SCHEMBL6819825 | 0.83 | GAA (0.36) | ALDH1A1TSHRPOLBGAACYP3A4 | |
| SCHEMBL1052265 | 0.82 | POLB (0.40) | ALDH1A1TSHRPOLBGAACYP3A4 | |
| SCHEMBL8532180 | 0.82 | POLB (0.40) | ALDH1A1TSHRPOLBGAACYP3A4 | |
| SCHEMBL11340725 | 0.81 | ALDH1A1 (0.45) | ALDH1A1TSHRPOLBGAACYP3A4 | |
| SCHEMBL14524858 | 0.79 | POLB (0.38) | ALDH1A1TSHRPOLBGAACYP3A4 | |
| SCHEMBL1051880 | 0.79 | POLB (0.53) | ALDH1A1TSHRPOLBGAACYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017194960-A1 | ASYMMETRIC CONJUGATE COMPOUNDS | FEMTOGENIX LIMITED (GB) | 2017-11-16 | — | — | WO | disclosed |
| US-6630488-B1 | Quinolizinones as integrin inhibitors | BIOCHEM PHARMA, INC. (CA) | 2003-10-07 | — | — | US | disclosed |
| EP-1115724-A1 | QUINOLIZINONES AS INTEGRIN INHIBITORS | Shire Biochem Inc. (CA) | 2001-07-18 | — | — | EP | disclosed |
| WO-2000017197-A1 | QUINOLIZINONES AS INTEGRIN INHIBITORS | BIOCHEM PHARMA INC. (US) | 2000-03-30 | — | — | WO | disclosed |