Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 3/20 | 0.46 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ACACB | O00763 | 1/20 | 0.44 |
| ▸ | RARB | P10826 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9510195 | 1.00 | NR5A1 (0.51) | NR5A1TP53TSHRLTA4HPLA2G4B | |
| SCHEMBL9508919 | 1.00 | NR5A1 (0.51) | NR5A1TP53TSHRLTA4HPLA2G4B | |
| SCHEMBL9511484 | 0.98 | NR5A1 (0.49) | NR5A1TP53TSHRLTA4HPLA2G4B | |
| SCHEMBL9509479 | 0.95 | ACACB (0.47) | NR5A1TSHRLTA4HL3MBTL1ACACB | |
| SCHEMBL9512274 | 0.89 | ACACB (0.50) | LTA4HL3MBTL1ACACB | |
| SCHEMBL9713683 | 0.88 | ACACB (0.48) | NR5A1TP53TSHRKDM4EALDH1A1 | |
| SCHEMBL9712808 | 0.88 | ACACB (0.48) | NR5A1TP53TSHRKDM4EALDH1A1 | |
| SCHEMBL9712970 | 0.88 | ACACB (0.48) | NR5A1TP53TSHRKDM4EALDH1A1 | |
| SCHEMBL9713057 | 0.87 | ACACB (0.49) | NR5A1LTA4HKDM4EALDH1A1HPGD | |
| SCHEMBL2056145 | 0.87 | LTA4H (0.52) | NR5A1TSHRLTA4HL3MBTL1GAA |
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-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | claimed |