Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | NMT2 | O60551 | 1/20 | 0.50 |
| ▸ | NMT1 | P30419 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.47 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.47 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.47 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HRH2 | P25021 | 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 | |
|---|---|---|---|---|
| SCHEMBL13168043 | 0.90 | ALDH1A1 (0.56) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL16707266 | 0.83 | ALDH1A1 (0.56) | ALDH1A1KDM4EMEN1KMT2ANMT2 | |
| SCHEMBL10102460 | 0.82 | ALDH1A1 (0.46) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL3709691 | 0.80 | ALDH1A1 (0.57) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL3527664 | 0.80 | ALDH1A1 (0.57) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL19260738 | 0.79 | ALDH1A1 (0.54) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL27249063 | 0.76 | ALDH1A1 (0.51) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL7838137 | 0.75 | KDM4E (0.61) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL13362941 | 0.75 | ALDH1A1 (0.58) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL300188 | 0.75 | ALDH1A1 (0.48) | ALDH1A1MEN1KMT2ALMNAHTT |
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-RE43098-E1 | Nitrogenous heterocyclic compounds and process for making nitrogenous heterocyclic compounds and intermediates thereof | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2012-01-10 | — | — | US | disclosed |