Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.53 |
| ▸ | PKM | P14618 | 4/20 | 0.53 |
| ▸ | GABRA5 | P31644 | 5/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2218827 | 1.00 | ALDH1A1 (0.53) | ALDH1A1PKMGABRA5NPSR1POLB | |
| SCHEMBL2219161 | 0.89 | ALDH1A1 (0.55) | ALDH1A1PKMGABRA5NPSR1PTGS2 | |
| SCHEMBL14438335 | 0.80 | ALDH1A1 (0.59) | ALDH1A1PKMGABRA5NPSR1PTGS2 | |
| SCHEMBL2217114 | 0.74 | GABRA5 (0.48) | ALDH1A1PKMGABRA5NPSR1MAPT | |
| SCHEMBL2218694 | 0.74 | PKM (0.46) | ALDH1A1PKMNPSR1CYP3A4CYP2C9 | |
| SCHEMBL23992068 | 0.72 | CASR (0.70) | ALDH1A1PKMPOLBLMNAHTT | |
| SCHEMBL12603184 | 0.72 | CASR (0.70) | ALDH1A1PKMPOLBLMNAHTT | |
| SCHEMBL16186450 | 0.72 | CASR (0.70) | ALDH1A1PKMPOLBLMNAHTT | |
| SCHEMBL11056381 | 0.71 | KMT2A (0.50) | ALDH1A1PKMPOLBPTGS2CYP3A4 | |
| SCHEMBL4586989 | 0.70 | PTGS2 (0.88) | PTGS2CYP3A4LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2212284-A2 | CALCIUM RECEPTOR MODULATING AGENTS | Amgen Inc. (US) | 2010-08-04 | — | — | EP | claimed |
| WO-2009051718-A2 | CALCIUM RECEPTOR MODULATING AGENTS | AMGEN INC. (US) | 2009-04-23 | — | — | WO | claimed |