Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Isoniazid. 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 | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 12/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.61 |
| ▸ | USP2 | O75604 | 9/20 | 0.61 |
| ▸ | RECQL | P46063 | 7/20 | 0.61 |
| ▸ | HPGD | P15428 | 7/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.61 |
| ▸ | THRB | P10828 | 6/20 | 0.61 |
| ▸ | LMNA | P02545 | 3/20 | 0.61 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.61 |
| ▸ | SIRT5 | Q9NXA8 | 2/20 | 0.61 |
| ▸ | MC4R | P32245 | 1/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 7/20 | 0.61 |
| ▸ | MEN1 | O00255 | 6/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.61 |
| ▸ | MAPT | P10636 | 5/20 | 0.61 |
| ▸ | POLB | P06746 | 3/20 | 0.61 |
| ▸ | RAD52 | P43351 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL20398184 | 0.89 | TDP1 (0.71) | TDP1KDM4EUSP2RECQLHPGD | |
| SCHEMBL4015 | 0.89 | TDP1 (0.73) | TDP1KDM4EUSP2RECQLHPGD | |
| Methacycline SCHEMBL5791578 | 0.79 | TDP1 (0.57) | TDP1KDM4EUSP2RECQLHPGD | |
| SCHEMBL26628251 | 0.77 | TDP1 (1.00) | TDP1KDM4EUSP2RECQLHPGD | |
| SCHEMBL26597994 | 0.77 | TDP1 (1.00) | TDP1KDM4EUSP2RECQLHPGD | |
| SCHEMBL30567156 | 0.77 | TDP1 (1.00) | TDP1KDM4EUSP2RECQLHPGD | |
| SCHEMBL19555132 | 0.77 | TDP1 (1.00) | TDP1KDM4EUSP2RECQLHPGD | |
| SCHEMBL29537520 | 0.77 | TDP1 (1.00) | TDP1KDM4EUSP2RECQLHPGD | |
| Hydrochloric Acid SCHEMBL29413670 | 0.76 | TDP1 (1.00) | TDP1KDM4EUSP2RECQLHPGD | |
| SCHEMBL12841672 | 0.76 | TDP1 (0.62) | TDP1KDM4EUSP2RECQLHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006021833-A2 | BISBENZAMIDINES FOR THE TREATMENT OF PNEUMONIA | UNIVERSITY OF CINCINNATI (US) | 2006-03-02 | — | — | WO | disclosed |
| US-20040009126-A1 | Inhalation system for prevention and treatment of intracellular infections | TRANSAVE, INC. (US) | 2004-01-15 | — | — | US | disclosed |