Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | STS | P08842 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | CDC25B | P30305 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17860841 | 0.74 | MAPT (0.46) | ALDH1A1MAPTPKM | |
| SCHEMBL8139136 | 0.72 | MAOB (0.43) | — | |
| SCHEMBL6288848 | 0.72 | TSHR (0.43) | TSHRALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL18099888 | 0.72 | TSHR (0.43) | TSHRALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL5936332 | 0.72 | TSHR (0.43) | TSHRALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL10689892 | 0.71 | TSHR (0.41) | TSHRSTSALDH1A1NPC1TP53 | |
| SCHEMBL10695089 | 0.68 | TSHR (0.41) | MGLLTSHRALDH1A1NPC1MAPT | |
| SCHEMBL3685760 | 0.64 | STING1 (0.37) | MGLLTSHRALDH1A1NPC1TP53 | |
| SCHEMBL29628298 | 0.63 | TSHR (0.44) | TSHR | |
| SCHEMBL18649887 | 0.63 | LTA4H (0.54) | TSHRALDH1A1NPC1MAPTRAB9A |
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-6956055-B2 | Substituted γ-lactone compounds as NMDA-antagonists | GRUNENTHAL GMBH (DE) | 2005-10-18 | — | — | US | disclosed |