Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.69 |
| ▸ | HPGD | P15428 | 2/20 | 0.69 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.69 |
| ▸ | MEN1 | O00255 | 4/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.63 |
| ▸ | CFTR | P13569 | 1/20 | 0.61 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 4/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.59 |
| ▸ | POLB | P06746 | 3/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.59 |
| ▸ | ESR1 | P03372 | 1/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | TYMS | P04818 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL50863 | 0.95 | TDP1 (0.75) | TDP1ALDH1A1CYP3A4HSD17B10HPGD | |
| SCHEMBL9328770 | 0.93 | CFTR (0.73) | TDP1ALDH1A1CYP3A4HSD17B10HPGD | |
| SCHEMBL28564000 | 0.87 | TDP1 (0.63) | TDP1ALDH1A1CYP3A4HSD17B10HPGD | |
| SCHEMBL29088535 | 0.86 | TDP1 (0.62) | TDP1ALDH1A1CYP3A4HSD17B10HPGD | |
| SCHEMBL31376524 | 0.86 | TDP1 (0.62) | TDP1ALDH1A1CYP3A4HSD17B10HPGD | |
| SCHEMBL9503404 | 0.83 | TDP1 (0.59) | TDP1ALDH1A1CYP3A4HSD17B10HPGD | |
| SCHEMBL9328656 | 0.83 | TDP1 (0.55) | TDP1ALDH1A1CYP3A4HSD17B10HPGD | |
| SCHEMBL10935899 | 0.82 | TDP1 (0.69) | TDP1ALDH1A1CYP3A4HSD17B10HPGD | |
| SCHEMBL4907834 | 0.82 | TDP1 (0.69) | TDP1ALDH1A1CYP3A4HSD17B10HPGD | |
| SCHEMBL27188 | 0.82 | ALDH1A1 (1.00) | TDP1ALDH1A1CYP3A4HSD17B10HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0855386-B1 | Process for the preparation on 3-(N,N-Dimethylamino)benzoic acid | CIBA SC HOLDING AG (CH) | 2004-08-04 | — | — | EP | disclosed |
| EP-0855386-A1 | Process for the preparation on 3-(N,N-Dimethylamino)benzoic acid | Ciba SC Holding AG (CH) | 1998-07-29 | — | — | EP | disclosed |