Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Trimethoprim. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | HTR6 | P50406 | 1/20 | 0.62 |
| ▸ | DHFR | P00374 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| Trimethoprim SCHEMBL30345188 | 0.89 | CYP2C19 (0.61) | ALDH1A1CYP3A4DHFRMEN1SLC22A1 | |
| Trimethoprim SCHEMBL4731560 | 0.88 | CYP2C19 (0.59) | ALDH1A1CYP3A4LMNADHFRMEN1 | |
| Trimethoprim SCHEMBL958034 | 0.84 | DHFR (0.63) | ALDH1A1CYP3A4DHFRMEN1SLC22A1 | |
| Trimethoprim SCHEMBL870329 | 0.84 | ALDH1A1 (0.58) | ALDH1A1CYP3A4DHFRMEN1SLC22A1 | |
| Trimethoprim SCHEMBL18094237 | 0.83 | DHFR (0.57) | ALDH1A1CYP3A4LMNADHFRMEN1 | |
| SCHEMBL9732799 | 0.82 | DHFR (0.58) | ALDH1A1CYP3A4LMNADHFRMEN1 | |
| Trimethoprim SCHEMBL29420800 | 0.81 | DHFR (0.59) | ALDH1A1CYP3A4DHFRMEN1SLC22A1 | |
| Trimethoprim SCHEMBL4182820 | 0.81 | DHFR (0.72) | ALDH1A1CYP3A4DHFRMEN1SLC22A1 | |
| Trimethoprim SCHEMBL28846304 | 0.81 | DHFR (0.63) | ALDH1A1CYP3A4DHFRMEN1SLC22A1 | |
| Trimethoprim SCHEMBL29674736 | 0.81 | ESR1 (0.63) | ALDH1A1CYP3A4DHFRMEN1SLC22A1 |
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-4332796-A | MICROCRYSTALS COATED WITH MIXTURES OF PHOSPHOLIPIDS AND NONIONIC SURFACTANTS | LABORATORIOS BAGO S.A. (AR) | 1982-06-01 | — | — | US | disclosed |