Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ERN1 | O75460 | 4/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | TLR2 | O60603 | 1/20 | 0.35 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.35 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.34 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL458508 | 0.80 | PIM1 (0.42) | TDP1MEN1LMNATHRBBLM | |
| SCHEMBL536090 | 0.79 | LMNA (0.55) | TDP1MEN1LMNATHRBBLM | |
| SCHEMBL29139204 | 0.78 | KMT2A (0.58) | TDP1MEN1LMNATHRBBLM | |
| SCHEMBL138254 | 0.78 | CA2 (0.55) | TDP1LMNAALOX12CA2ALDH1A1 | |
| SCHEMBL17261584 | 0.78 | TDP1 (0.42) | TDP1MEN1LMNATHRBBLM | |
| SCHEMBL794071 | 0.76 | TDP1 (0.41) | TDP1MEN1LMNATHRBBLM | |
| SCHEMBL31587806 | 0.76 | ALOX12 (0.62) | TDP1MEN1LMNATHRBBLM | |
| SCHEMBL15428022 | 0.76 | LMNA (0.41) | TDP1MEN1LMNATHRBBLM | |
| SCHEMBL173039 | 0.76 | ALOX12 (0.62) | TDP1MEN1LMNATHRBBLM | |
| Formaldehyde SCHEMBL28869544 | 0.75 | TDP1 (0.50) | TDP1MEN1LMNATHRBBLM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111848675-B | Tetrahydroquinoline framework chiral phosphine-nitrogen ligand and preparation method and application thereof | 中国科学院化学研究所 | 2021-09-07 | — | — | CN | disclosed |
| CN-111848675-A | Tetrahydroquinoline framework chiral phosphine-nitrogen ligand and preparation method and application thereof | 中国科学院化学研究所 | 2020-10-30 | — | — | CN | disclosed |