Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 6/20 | 0.36 |
| ▸ | CA9 | Q16790 | 6/20 | 0.36 |
| ▸ | CA1 | P00915 | 5/20 | 0.36 |
| ▸ | CA12 | O43570 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11761628 | 0.91 | PTGS2 (0.42) | EGFRERBB2MAPTCYP1A2CYP3A4 | |
| SCHEMBL11757498 | 0.88 | LMNA (0.48) | MAPTCYP2C19LMNASMN1; SMN2CA2 | |
| SCHEMBL11756711 | 0.88 | LMNA (0.41) | EGFRERBB2LMNASMN1; SMN2CA2 | |
| SCHEMBL11760253 | 0.84 | MAPT (0.49) | EGFRERBB2MAPTCYP1A2CYP3A4 | |
| SCHEMBL11760805 | 0.83 | MAPT (0.38) | EGFRERBB2MAPTCYP1A2CYP3A4 | |
| SCHEMBL11757426 | 0.81 | LMNA (0.41) | EGFRERBB2LMNASMN1; SMN2CA2 | |
| SCHEMBL11760541 | 0.80 | MAOB (0.46) | MAPTLMNASMN1; SMN2KMT2AMAOA | |
| SCHEMBL11755819 | 0.80 | HTR2C (0.51) | MAPTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11761518 | 0.78 | LMNA (0.49) | MAPTCYP2C19LMNACA2CA9 | |
| SCHEMBL11759406 | 0.78 | LMNA (0.39) | EGFRERBB2LMNASMN1; SMN2GAA |
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-4031232-A | 1-Alkyl-2-(phenoxymethyl)-5-nitro-imidazoles and process for their manufacture | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-06-21 | — | — | US | disclosed |