Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.38 |
| ▸ | TRPC5 | Q9UL62 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL14939274 | 0.92 | NPSR1 (0.44) | KMT2ANPSR1ALDH1A1LMNAMEN1 | |
| SCHEMBL14938968 | 0.89 | ALDH1A1 (0.45) | KMT2ANPSR1ALDH1A1MEN1KDM4E | |
| SCHEMBL14939998 | 0.88 | MEN1 (0.45) | KMT2ANPSR1ALDH1A1MEN1KDM4E | |
| SCHEMBL14939776 | 0.87 | NPSR1 (0.59) | NPSR1ALDH1A1LMNAKDM4EMAPT | |
| SCHEMBL14939886 | 0.85 | NPSR1 (0.47) | KMT2ANPSR1ALDH1A1LMNAMEN1 | |
| SCHEMBL14939131 | 0.85 | KMT2A (0.46) | KMT2ANPSR1ALDH1A1LMNAMEN1 | |
| SCHEMBL14940304 | 0.83 | NPSR1 (0.46) | KMT2ANPSR1ALDH1A1LMNAMEN1 | |
| SCHEMBL14939589 | 0.83 | NPSR1 (0.48) | KMT2ANPSR1ALDH1A1LMNAMEN1 | |
| SCHEMBL14939691 | 0.82 | KMT2A (0.43) | KMT2ANPSR1ALDH1A1LMNAMEN1 | |
| SCHEMBL14938959 | 0.82 | NPSR1 (0.48) | KMT2ANPSR1ALDH1A1LMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | claimed |
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |