Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.69 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.67 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | CASP6 | P55212 | 1/20 | 0.53 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | NOS1 | P29475 | 3/20 | 0.49 |
| ▸ | NOS2 | P35228 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | APEX1 | P27695 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30696914 | 0.94 | ALDH1A1 (0.68) | ALDH1A1TDP1TSHRCASP6GPR35 | |
| SCHEMBL579426 | 0.94 | ALDH1A1 (0.68) | ALDH1A1TDP1TSHRCASP6GPR35 | |
| SCHEMBL9734521 | 0.93 | ALDH1A1 (0.67) | ALDH1A1TDP1TSHRCASP6GPR35 | |
| SCHEMBL5167844 | 0.92 | ALDH1A1 (0.66) | ALDH1A1TDP1TSHRCASP6GPR35 | |
| SCHEMBL419966 | 0.86 | ALDH1A1 (0.58) | ALDH1A1TDP1TSHRCASP6GPR35 | |
| SCHEMBL1802531 | 0.86 | ALDH1A1 (0.58) | ALDH1A1TDP1TSHRCASP6GPR35 | |
| SCHEMBL11284187 | 0.86 | ERN1 (0.56) | ALDH1A1TDP1TSHRCASP6GPR35 | |
| Benzoquinone SCHEMBL28192198 | 0.86 | ALDH1A1 (0.58) | ALDH1A1TDP1TSHRCASP6GPR35 | |
| SCHEMBL8535897 | 0.84 | ALDH1A1 (0.51) | ALDH1A1TDP1TSHRCASP6CYP3A4 | |
| SCHEMBL9455556 | 0.84 | TSHR (0.57) | ALDH1A1TDP1TSHRCASP6GPR35 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107298727-B | A kind of preparation and application of double salicylaldehyde imines-anthracene bimetallic titanium catalyst | 青岛科技大学 | 2019-07-26 | — | — | CN | disclosed |
| CN-107298727-A | A kind of preparation and application of double salicylaldehyde imines anthracene bimetallic titanium catalyst | 青岛科技大学 | 2017-10-27 | — | — | CN | disclosed |
| US-5086128-A | HIGH MOLECULAR WEIGHT ARYLENE SULPHIDE POLYMER MELT MIXED WITH AROMATIC NITRO COMPOUND | BAYER AKTIENGESELLSCHAFT (DE) | 1992-02-04 | — | — | US | disclosed |