Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 6/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.46 |
| ▸ | MAPT | P10636 | 7/20 | 0.46 |
| ▸ | HPGD | P15428 | 6/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 1/20 | 0.42 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6180023 | 0.81 | NPC1 (0.55) | RAB9AMEN1KMT2ANPC1TDP1 | |
| SCHEMBL7665534 | 0.81 | TDP1 (0.44) | RAB9AMEN1KMT2ANPC1TDP1 | |
| SCHEMBL9822779 | 0.79 | TDP1 (0.72) | CYP2A6RAB9AMEN1KMT2ANPC1 | |
| SCHEMBL7667596 | 0.79 | TDP1 (0.41) | RAB9AMEN1KMT2ANPC1TDP1 | |
| SCHEMBL24920314 | 0.78 | NPC1 (0.51) | RAB9AMEN1KMT2ANPC1TDP1 | |
| SCHEMBL9091793 | 0.78 | TDP1 (0.50) | CYP2A6RAB9AMEN1KMT2ANPC1 | |
| SCHEMBL9823025 | 0.75 | NPC1 (0.75) | RAB9AMEN1KMT2ANPC1TDP1 | |
| SCHEMBL599006 | 0.74 | CYP2A6 (0.79) | CYP2A6RAB9AMEN1KMT2ANPC1 | |
| SCHEMBL29451111 | 0.74 | CYP2A6 (0.79) | CYP2A6RAB9AMEN1KMT2ANPC1 | |
| SCHEMBL9823028 | 0.74 | KMT2A (0.51) | RAB9AMEN1KMT2ANPC1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0288898-B1 | SUBSTITUTED CHINOXALYL-IMIDAZOLIDINE-2,4-DIONES, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICAMENTS AND PHARMACOLOGICAL PREPARATIONS | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-08-14 | — | — | EP | disclosed |
| US-4943576-A | ENZYME INHIBITORS | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-07-24 | — | — | US | disclosed |