Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPRC | P08575 | 6/20 | 0.41 |
| ▸ | S100A4 | P26447 | 3/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.40 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28194068 | 0.80 | S100A4 (0.47) | PTPRCS100A4BCHEACHECES1 | |
| SCHEMBL68629 | 0.79 | PTPRC (0.46) | PTPRCCES1POLBMEN1KMT2A | |
| SCHEMBL71119 | 0.76 | FGFR1 (0.50) | PTPRCCES1POLBMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL28890346 | 0.75 | FGFR1 (0.48) | PTPRCCES1MEN1KMT2AALDH1A1 | |
| SCHEMBL10797390 | 0.74 | IDO1 (0.44) | PTPRCS100A4POLBMEN1KMT2A | |
| SCHEMBL68339 | 0.69 | IDO1 (0.44) | PTPRCCES1POLBMEN1KMT2A | |
| SCHEMBL19230417 | 0.68 | ALDH1A1 (0.52) | PTPRCS100A4BCHECES1POLB | |
| SCHEMBL29364188 | 0.65 | MEN1 (0.56) | PTPRCS100A4BCHECES1POLB | |
| SCHEMBL30130196 | 0.65 | MEN1 (0.56) | PTPRCS100A4BCHECES1POLB | |
| SCHEMBL354514 | 0.65 | MEN1 (0.56) | PTPRCS100A4BCHECES1POLB |
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 |
|---|---|---|---|---|---|---|---|
| JP-5194329-A | — | — | None | — | — | JP | disclosed |
| JP-H05194329-A | PREPARATION OF 1-NITROANTHRAQUINONE-2-CARBOXYLIC ACID | BASF AG | 1993-08-03 | — | — | JP | disclosed |