Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | SLC14A1 | Q13336 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.43 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.41 |
| ▸ | NCK1 | P16333 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22237927 | 0.81 | ERN1 (0.37) | MEN1KMT2ASLC14A1IKBKBKDM4E | |
| SCHEMBL2720662 | 0.81 | TSHR (0.44) | MEN1KMT2APDE3BPDE3ABACE1 | |
| SCHEMBL31220360 | 0.81 | ALDH1A1 (0.43) | CYP1A2BACE1ALDH1A1HTTDYRK1A | |
| SCHEMBL6565240 | 0.81 | RXFP1 (0.43) | MEN1KMT2APDE3BPDE3ADAO | |
| SCHEMBL6567169 | 0.79 | ALDH1A1 (0.52) | MEN1KMT2ACYP1A2PDE3BPDE3A | |
| SCHEMBL2975427 | 0.79 | KDM4E (0.56) | MEN1KMT2ACYP1A2HSD17B14IKBKB | |
| SCHEMBL6565239 | 0.76 | PDE3B (0.49) | KMT2APDE3BPDE3AKDM4EALDH1A1 | |
| SCHEMBL13544940 | 0.76 | NQO2 (0.48) | MEN1KMT2ASLC14A1CYP2A6CYP1A2 | |
| SCHEMBL8177959 | 0.76 | ALDH1A1 (0.62) | MEN1KMT2ACYP2A6CYP1A2HSD17B14 | |
| SCHEMBL6565253 | 0.74 | TDP1 (0.43) | KMT2AMAPTSMN1; SMN2HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-5726305-A | Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-03-10 | — | — | US | disclosed |
| US-5719164-A | Substituted quinoline-2-carboxamides, their preparation and their use as pharmaceuticals, and intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-02-17 | — | — | US | disclosed |