Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | NMT2 | O60551 | 1/20 | 0.44 |
| ▸ | NMT1 | P30419 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | TACR3 | P29371 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL398408 | 0.96 | SMN1; SMN2 (0.54) | SMN1; SMN2MEN1KMT2ALMNAKDM4E | |
| SCHEMBL394571 | 0.88 | POLB (0.58) | MEN1KMT2ALMNAKDM4EALDH1A1 | |
| SCHEMBL10256419 | 0.84 | POLB (0.46) | SMN1; SMN2MEN1KMT2ALMNAKDM4E | |
| SCHEMBL7412714 | 0.83 | KDM4E (0.56) | SMN1; SMN2MEN1KMT2ALMNAKDM4E | |
| SCHEMBL753481 | 0.78 | POLB (0.51) | SMN1; SMN2MEN1KMT2ALMNAKDM4E | |
| SCHEMBL22646 | 0.77 | POLB (0.54) | MEN1KMT2AKDM4EPOLBNPC1 | |
| SCHEMBL11071729 | 0.77 | LMNA (0.50) | SMN1; SMN2MEN1KMT2ALMNAKDM4E | |
| SCHEMBL22377 | 0.77 | PDE10A (0.57) | SMN1; SMN2MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL27693524 | 0.77 | KMT2A (0.54) | MEN1KMT2ALMNAKDM4EALDH1A1 | |
| SCHEMBL31422937 | 0.74 | ALDH1A1 (0.50) | SMN1; SMN2MEN1KMT2ALMNAKDM4E |
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-1773816-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2007-04-18 | — | — | EP | disclosed |
| WO-2006002421-A2 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-01-05 | — | — | WO | disclosed |