Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23616906 | 0.80 | AKR1B1 (0.47) | TSHRALDH1A1KMT2AMEN1CYP2D6 | |
| SCHEMBL28899623 | 0.79 | IDO1 (0.40) | TSHRCYP4F2CYP4A11PKMALDH1A1 | |
| SCHEMBL28392837 | 0.79 | PKM (0.53) | TSHRCYP4F2CYP4A11PKMALDH1A1 | |
| SCHEMBL23616865 | 0.77 | LMNA (0.50) | TSHRSMN1; SMN2KMT2AMEN1CYP1A2 | |
| SCHEMBL28463483 | 0.76 | SLC6A2 (0.41) | TSHRCYP4F2CYP4A11CYP1A2CYP3A4 | |
| SCHEMBL11272272 | 0.73 | PKM (0.41) | PKMALDH1A1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL3251246 | 0.73 | ALDH1A1 (0.44) | TSHRALDH1A1SMN1; SMN2KMT2AHSD17B10 | |
| SCHEMBL150237 | 0.68 | TSHR (0.50) | TSHRALDH1A1KMT2ACYP1A2 | |
| SCHEMBL29350459 | 0.68 | TSHR (0.50) | TSHRALDH1A1KMT2ACYP1A2 | |
| SCHEMBL2825239 | 0.68 | TSHR (0.69) | TSHRALDH1A1KMT2AKDM4EHSD17B10 |
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-0773931-A1 | QUINOLINE DERIVATIVES AS LEUKOTRIENE ANTAGONISTS | LEO PHARMACEUTICAL PRODUCTS LTD. A/S (LOVENS KEMISKE FABRIK PRODUKTIONSAKTIESELSKAB) (DK) | 1997-05-21 | — | — | EP | disclosed |
| WO-1996002506-A1 | QUINOLINE DERIVATIVES AS LEUKOTRIENE ANTAGONISTS | Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) | 1996-02-01 | — | — | WO | disclosed |