Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | ACHE | P22303 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10784001 | 0.87 | ACHE (0.55) | DHFRHSD17B10ACHEALDH1A1CYP2C9 | |
| SCHEMBL10502213 | 0.87 | GAA (0.40) | HSD17B10ALDH1A1CYP2C9CYP2C19MEN1 | |
| SCHEMBL10502995 | 0.87 | TSHR (0.47) | HSD17B10ALDH1A1CYP2C9CYP2C19MEN1 | |
| SCHEMBL10746130 | 0.84 | ACHE (0.43) | ACHE | |
| SCHEMBL10503110 | 0.83 | CACNA1D (0.46) | HSD17B10ACHEALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL11001264 | 0.83 | CYP2C9 (0.49) | HSD17B10ALDH1A1CYP2C9CYP2C19MEN1 | |
| SCHEMBL10503447 | 0.82 | DHFR (0.43) | DHFRHSD17B10ACHEALDH1A1CYP2C9 | |
| SCHEMBL4407407 | 0.81 | PKM (0.56) | DHFRHSD17B10ACHEALDH1A1CYP2C9 | |
| SCHEMBL10502956 | 0.81 | KDM4E (0.51) | HSD17B10ALDH1A1CYP2C9CYP2C19GAA | |
| SCHEMBL9690374 | 0.80 | PKM (0.46) | HSD17B10ALDH1A1MEN1KMT2APOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0133530-A2 | 1,6-Naphthyridinone derivatives, process for their preparation, and medicaments containing them | GÖDECKE AKTIENGESELLSCHAFT (DE) | 1985-02-27 | — | — | EP | disclosed |