Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | BLM | P54132 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | CASP1 | P29466 | 2/20 | 0.44 |
| ▸ | PTPN7 | P35236 | 2/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | CASP7 | P55210 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1799678 | 0.73 | ALDH1A1 (0.63) | NISCHALDH1A1KDM4EMAPTPOLB | |
| SCHEMBL6909709 | 0.70 | NISCH (0.46) | NISCHALDH1A1KDM4EMAPTPOLB | |
| SCHEMBL1607474 | 0.69 | NISCH (0.44) | NISCHALDH1A1KDM4EMAPTPOLB | |
| SCHEMBL498016 | 0.67 | — | — | |
| Piperazine SCHEMBL3365003 | 0.67 | TAAR1 (0.50) | NISCHALDH1A1KDM4EMAPTPOLB | |
| SCHEMBL394300 | 0.66 | TAAR1 (0.76) | ALDH1A1KDM4EMAPTPOLBMEN1 | |
| SCHEMBL27397905 | 0.64 | NISCH (0.53) | NISCHALDH1A1KDM4EMAPTPOLB | |
| SCHEMBL11974601 | 0.64 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTPOLBMEN1 | |
| SCHEMBL11974593 | 0.64 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTPOLBMEN1 | |
| SCHEMBL11974594 | 0.64 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTPOLBMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20050282740-A1 | Methods and compositions for regulating protein-protein interactions | LU KUN P | 2005-12-22 | — | — | US | disclosed |
| EP-1028946-A1 | INDAZOLE BIOISOSTERE REPLACEMENT OF CATECHOL IN THERAPEUTICALLY ACTIVE COMPOUNDS | Pfizer Products Inc. (US) | 2000-08-23 | — | — | EP | disclosed |
| WO-1999023077-A1 | INDAZOLE BIOISOSTERE REPLACEMENT OF CATECHOL IN THERAPEUTICALLY ACTIVE COMPOUNDS | PFIZER PRODUCTS INC. (US) | 1999-05-14 | — | — | WO | disclosed |