Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 6/20 | 0.51 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.51 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 7/20 | 0.42 |
| ▸ | NSD2 | O96028 | 1/20 | 0.42 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.41 |
| ▸ | RET | P07949 | 5/20 | 0.41 |
| ▸ | KIF5B | P33176 | 5/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.41 |
| ▸ | FLT1 | P17948 | 2/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.41 |
| ▸ | EPHB2 | P29323 | 1/20 | 0.41 |
| ▸ | TTBK1 | Q5TCY1 | 1/20 | 0.41 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5828880 | 1.00 | KDR (0.51) | KDREPHA2EPHB4ALDH1A1HPGD | |
| SCHEMBL5828980 | 0.94 | KDR (0.46) | KDREPHA2EPHB4EGFRRET | |
| SCHEMBL5828988 | 0.94 | KDR (0.46) | KDREPHA2EPHB4EGFRRET | |
| SCHEMBL5828058 | 0.94 | KDR (0.48) | KDREPHA2EPHB4HPGDHTT | |
| SCHEMBL5828053 | 0.94 | KDR (0.48) | KDREPHA2EPHB4HPGDHTT | |
| SCHEMBL6981911 | 0.80 | HTT (0.48) | KDRALDH1A1HPGDHTTEGFR | |
| SCHEMBL6985649 | 0.78 | RET (0.49) | KDRALDH1A1HPGDHTTEGFR | |
| SCHEMBL7089596 | 0.78 | KDR (0.48) | KDREPHA2EPHB4HPGDHTT | |
| SCHEMBL7090020 | 0.78 | KDR (0.45) | KDREPHA2EPHB4EGFRRET | |
| SCHEMBL6980090 | 0.77 | EGFR (0.60) | KDREGFRRETKIF5BFGFR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7001904-B1 | Guanidine derivatives quinazoline and quinoline for use in the treatment of autoimmune diseases | ASTRAZENECA AB (SE) | 2006-02-21 | — | — | US | disclosed |