Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | C1S | P09871 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.36 |
| ▸ | SLC9A3 | P48764 | 1/20 | 0.36 |
| ▸ | SLC9A2 | Q9UBY0 | 1/20 | 0.36 |
| ▸ | SLC6A19 | Q695T7 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7572617 | 0.79 | TP53 (0.46) | ALDH1A1PKMMEN1KMT2APARP1 | |
| SCHEMBL7572362 | 0.79 | MAOB (0.49) | PKMPARP1MAPT | |
| SCHEMBL7575017 | 0.79 | GRIN1 (0.47) | ALDH1A1PKMMEN1KMT2APARP1 | |
| SCHEMBL7581379 | 0.77 | NPC1 (0.41) | ALDH1A1MEN1KMT2AMAPTNPSR1 | |
| SCHEMBL7572848 | 0.77 | MCL1 (0.46) | ALDH1A1MEN1KMT2AAKR1C3MAPT | |
| SCHEMBL27589991 | 0.76 | ALDH1A1 (0.50) | HSD17B3ALDH1A1PKMMEN1KMT2A | |
| SCHEMBL7579146 | 0.75 | TAAR1 (0.51) | ALDH1A1MEN1KMT2APARP1MAPT | |
| SCHEMBL22202969 | 0.72 | ALDH1A1 (0.56) | HSD17B3ALDH1A1PKMMEN1KMT2A | |
| SCHEMBL7573955 | 0.72 | FBP1 (0.57) | ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL15684339 | 0.71 | C1S (0.47) | HSD17B3ALDH1A1PKMMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0810199-B1 | Method for producing propargylamine compounds | SUMITOMO CHEMICAL CO (JP) | 2002-09-25 | — | — | EP | disclosed |
| US-5756769-A | Method for producing propargylamine compounds | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1998-05-26 | — | — | US | disclosed |
| EP-0810199-A1 | Method for producing propargylamine compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-12-03 | — | — | EP | disclosed |