Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.54 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.54 |
| ▸ | HTR2B | P41595 | 1/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 2/20 | 0.52 |
| ▸ | FAAH | O00519 | 1/20 | 0.51 |
| ▸ | CNR1 | P21554 | 1/20 | 0.51 |
| ▸ | CNR2 | P34972 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL25788178 | 0.94 | KMT2A (0.62) | ALDH1A1TSHRNPSR1MEN1KMT2A | |
| SCHEMBL7983551 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TSHRNPSR1MEN1KMT2A | |
| SCHEMBL7983685 | 0.87 | HCRTR1 (0.65) | ALDH1A1TSHRMEN1KMT2AMAPT | |
| SCHEMBL7983714 | 0.86 | ALDH1A1 (0.54) | ALDH1A1TSHRNPSR1MEN1KMT2A | |
| SCHEMBL7966214 | 0.82 | ALDH1A1 (0.61) | ALDH1A1TSHRNPSR1MEN1KMT2A | |
| SCHEMBL10257995 | 0.82 | MEN1 (0.68) | ALDH1A1TSHRNPSR1MEN1KMT2A | |
| SCHEMBL7966210 | 0.81 | TSHR (0.63) | ALDH1A1TSHRNPSR1MEN1KMT2A | |
| SCHEMBL11331258 | 0.79 | ALDH1A1 (0.78) | ALDH1A1TSHRNPSR1MEN1KMT2A | |
| SCHEMBL2169790 | 0.79 | CTSD (0.62) | ALDH1A1TSHRMAPTLMNATP53 | |
| SCHEMBL30744822 | 0.79 | CTSD (0.62) | ALDH1A1TSHRMAPTLMNATP53 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6331628-B1 | REACTING A SUBSTITUTED HALOBENZENE WITH POTASSIUM, SODIUM AND/OR ZINC CYANIDE IN THE PRESENCE OF A METALLIC CATALYST | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2001-12-18 | — | — | US | disclosed |