Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | GBA1 | P04062 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.30 |
| ▸ | HRH2 | P25021 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL11168502 | 0.93 | ALOX15 (0.35) | ESR1ALOX15ALDH1A1NPC1MAPT | |
| SCHEMBL11162900 | 0.92 | ESR1 (0.36) | ESR1ALOX15ALDH1A1NPC1MAPT | |
| SCHEMBL11267586 | 0.91 | ESR1 (0.36) | ESR1ALOX15ALDH1A1NPC1MAPT | |
| SCHEMBL11264434 | 0.89 | ALOX15 (0.35) | ESR1ALOX15ALDH1A1NPC1MAPT | |
| SCHEMBL11153059 | 0.84 | LMNA (0.43) | ESR1ALOX15ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL11163314 | 0.84 | ESR1 (0.41) | ESR1ALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL11153209 | 0.83 | LMNA (0.44) | ESR1ALOX15ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL11156879 | 0.83 | ESR1 (0.42) | ESR1ALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL11155491 | 0.81 | HDAC6 (0.36) | ESR1ALOX15ALDH1A1NPC1MAPT | |
| SCHEMBL11155858 | 0.80 | TTR (0.40) | AKR1C3LMNATBXA2RHIF1ACYP3A4 |
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-4362738-A | ANTIINFLAMMATORIES | DR. KARL THOMAE GMBH (DE) | 1982-12-07 | — | — | US | disclosed |
| EP-0024282-A1 | Benzoyl derivatives, their preparation and their use as medicines | Dr. Karl Thomae GmbH (DE) | 1981-03-04 | — | — | EP | disclosed |