Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.46 |
| ▸ | TYMS | P04818 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 3/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10460758 | 0.83 | EGFR (0.48) | TYMSEGFRERBB2ALDH1A1MAPK1 | |
| Flunidazole SCHEMBL636164 | 0.81 | MAPK1 (0.59) | TYMSEGFRERBB2ALDH1A1MAPK1 | |
| SCHEMBL2558351 | 0.76 | TYMS (0.47) | TYMSEGFRERBB2ALDH1A1MAPK1 | |
| SCHEMBL11824972 | 0.74 | EGFR (0.58) | MAPTEGFRERBB2ALDH1A1SMN1; SMN2 | |
| SCHEMBL11834463 | 0.74 | CA1 (0.53) | TYMSEGFRERBB2ALDH1A1MAPK1 | |
| SCHEMBL7474776 | 0.71 | ALDH1A1 (0.46) | MAPTAPOBEC3GALDH1A1HPGDCYP2C19 | |
| SCHEMBL11418098 | 0.71 | ALDH1A1 (0.42) | MAPTTDP1APOBEC3GALDH1A1MAPK1 | |
| SCHEMBL11852466 | 0.71 | ALDH1A1 (0.42) | MAPTTDP1APOBEC3GALDH1A1MAPK1 | |
| SCHEMBL10402051 | 0.70 | MAPK1 (0.44) | TYMSEGFRERBB2ALDH1A1MAPK1 | |
| SCHEMBL11787672 | 0.70 | ALDH1A1 (0.48) | MAPTTDP1APOBEC3GALDH1A1MAPK1 |
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-3941801-A | Process for preparing substituted nitroimidazoles | MERCK & CO., INC. (US) | 1976-03-02 | — | — | US | disclosed |