Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SCN4A | P35499 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7804008 | 0.90 | NPC1 (0.46) | HSP90AA1HSP90AB1NPC1RAB9ACYP1A2 | |
| SCHEMBL7806796 | 0.87 | KMT2A (0.45) | HSP90AA1HSP90AB1NPC1RAB9ACYP1A2 | |
| SCHEMBL7806822 | 0.86 | HSP90AA1 (0.53) | HSP90AA1HSP90AB1NPC1RAB9ACYP1A2 | |
| SCHEMBL7808650 | 0.86 | KMT2A (0.50) | HSP90AA1HSP90AB1RAB9ACYP1A2SMN1; SMN2 | |
| SCHEMBL14879957 | 0.86 | NUDT1 (0.54) | HSP90AA1HSP90AB1NPC1RAB9ACYP1A2 | |
| SCHEMBL8873887 | 0.85 | NPC1 (0.50) | HSP90AA1HSP90AB1NPC1RAB9ACYP1A2 | |
| SCHEMBL7935910 | 0.82 | HSP90AA1 (0.35) | HSP90AA1HSP90AB1NPC1RAB9ACYP1A2 | |
| SCHEMBL8873520 | 0.81 | HSP90AA1 (0.33) | HSP90AA1HSP90AB1NPC1RAB9ACYP1A2 | |
| SCHEMBL8873952 | 0.81 | NUDT1 (0.46) | HSP90AA1HSP90AB1CYP1A2NUDT1CYP2C19 | |
| SCHEMBL8874379 | 0.81 | NUDT1 (0.54) | NUDT1DHFR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6235904-B1 | VALUABLE INTERMEDIATES FOR ORGANIC SYNTHESES, ESPECIALLY FOR PREPARING CROP PROTECTION AGENTS. | BASF AKTIENGESELLSCHAFT (DE) | 2001-05-22 | — | — | US | disclosed |
| EP-0445642-B1 | 2-Amino-(fluoralkoxy-pyrimidines) and process for their preparation | BASF AG (DE) | 1995-07-12 | — | — | EP | disclosed |
| US-5283332-A | 2-amino(fluoroalkoxy)pyrimidines and the preparation thereof | BASF AKTIENGESELLSCHAFT (DE) | 1994-02-01 | — | — | US | disclosed |
| EP-0445642-A1 | 2-Amino-(fluoralkoxy-pyrimidines) and process for their preparation | BASF Aktiengesellschaft (DE) | 1991-09-11 | — | — | EP | disclosed |