Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Mequinol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 2/20 | 0.68 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.61 |
| ▸ | LTA4H | P09960 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | APP | P05067 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 3/20 | 0.52 |
| ▸ | AGXT | P21549 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | APAF1 | O14727 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Anisole SCHEMBL27772542 | 0.90 | CALM1 (0.56) | CALM1ESR2LTA4HSMN1; SMN2MAPT | |
| SCHEMBL30878 | 0.89 | CA12 (0.61) | CALM1LTA4HSMN1; SMN2MAPTLMNA | |
| Bromide SCHEMBL28187052 | 0.86 | IDO1 (0.58) | CALM1LTA4HSMN1; SMN2MAPTLMNA | |
| Ammonia Solution, Strong SCHEMBL266020 | 0.86 | IDO1 (0.58) | CALM1LTA4HSMN1; SMN2MAPTLMNA | |
| SCHEMBL1126411 | 0.84 | MEN1 (0.64) | CALM1ESR2LTA4HSMN1; SMN2MAPT | |
| SCHEMBL3417942 | 0.84 | CALM1 (0.70) | CALM1ESR2LTA4HSMN1; SMN2MAPT | |
| SCHEMBL3414787 | 0.84 | CALM1 (0.84) | CALM1ESR2LTA4HSMN1; SMN2MAPT | |
| Bromide SCHEMBL25274321 | 0.84 | IDO1 (0.56) | CALM1LTA4HSMN1; SMN2MAPTLMNA | |
| Mequinol SCHEMBL10605062 | 0.84 | ESR2 (0.70) | CALM1ESR2LTA4HSMN1; SMN2NPC1 | |
| SCHEMBL8709940 | 0.84 | ALDH1A1 (0.55) | CALM1ESR2MAPTLMNAIDO1 |
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-4988655-A | A coordination catalyst for polymerization of alpha-olefins made from a magnesium dihalide, a phenol, an alkylbenzoate, a titanium compound and an aluminum compound | PHILLIPS PETROLEUM COMPANY (US) | 1991-01-29 | — | — | US | disclosed |