Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | IDO1 | P14902 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | MAOA | P21397 | 3/20 | 0.45 |
| ▸ | MAOB | P27338 | 3/20 | 0.45 |
| ▸ | PTGIR | P43119 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4851422 | 0.90 | LMNA (0.48) | CYP3A4PTGS2TDP1LMNACYP1A2 | |
| SCHEMBL17948202 | 0.80 | ALDH1A1 (0.60) | CYP3A4PTGS2TDP1LMNACYP1A2 | |
| SCHEMBL11543435 | 0.79 | MAPT (0.53) | CYP3A4PTGS2TDP1LMNACYP1A2 | |
| SCHEMBL31332184 | 0.79 | PTGIR (0.49) | CYP3A4PTGS2TDP1LMNACYP1A2 | |
| SCHEMBL14683165 | 0.79 | MEN1 (0.49) | CYP3A4PTGS2TDP1LMNACYP1A2 | |
| SCHEMBL23277364 | 0.79 | MAOA (0.62) | CYP3A4MAOAMAOBSLC6A4HPGD | |
| SCHEMBL795030 | 0.79 | MAOA (0.62) | CYP3A4MAOAMAOBSLC6A4HPGD | |
| SCHEMBL3891569 | 0.79 | MAOA (0.62) | CYP3A4MAOAMAOBSLC6A4HPGD | |
| SCHEMBL3891151 | 0.79 | MAOA (0.62) | CYP3A4MAOAMAOBSLC6A4HPGD | |
| Hydrochloric Acid SCHEMBL14675465 | 0.77 | MEN1 (0.47) | CYP3A4PTGS2TDP1LMNACYP1A2 |
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-4179439-A | Rifamycins and method for their preparation | INTREPRINDEREA DE ANTIBIOTICE IASI (RO) | 1979-12-18 | — | — | US | disclosed |