Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28810021 | 0.74 | ACHE (0.39) | CYP19A1ALDH1A1KDM4EPOLBHPGD | |
| SCHEMBL16130561 | 0.74 | ACACB (0.49) | TSHRMAPT | |
| Oxalic Acid SCHEMBL11187806 | 0.73 | LMNA (0.36) | AOC3ALDH1A1KDM4EHPGDSMN1; SMN2 | |
| SCHEMBL9348326 | 0.73 | ROCK2 (0.43) | CYP19A1ALDH1A1KDM4ESMN1; SMN2HTT | |
| SCHEMBL11484145 | 0.71 | AOC3 (0.36) | AOC3ALDH1A1KDM4EPOLBSMN1; SMN2 | |
| SCHEMBL1677568 | 0.71 | FFAR1 (0.54) | CYP19A1ALDH1A1KCNA5TSHRL3MBTL1 | |
| SCHEMBL9546454 | 0.71 | ALDH1A1 (0.54) | ALDH1A1POLBSMN1; SMN2HTTTSHR | |
| SCHEMBL5669159 | 0.70 | MME (0.41) | CYP19A1ALDH1A1MAOAMAOBPTGS2 | |
| Hydrochloric Acid SCHEMBL11178931 | 0.70 | AOC3 (0.35) | AOC3ALDH1A1KDM4EPOLBSMN1; SMN2 | |
| SCHEMBL1678301 | 0.69 | ACHE (0.41) | CYP19A1ALDH1A1KDM4EMAOAMAOB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4421601-A | LACQUERS, INKS, PAINTS, TEXTILES, PAPER | BAYER AKTIENGESELLSCHAFT (DE) | 1983-12-20 | — | — | US | disclosed |
| US-4370328-A | Cardiac stimulant 1-(3- or 4-substituted piperidino)phthalazines | PFIZER INC. (US) | 1983-01-25 | — | — | US | disclosed |
| US-4188391-A | 4-[4-(Substituted)piperidino]quinazoline cardiac stimulants | PFIZER INC. (US) | 1980-02-12 | — | — | US | disclosed |
| US-4014863-A | LACQUERS, PRINTING INKS, PAINTS | BAYER AKTIENGESELLSCHAFT (DT) | 1977-03-29 | — | — | US | disclosed |