Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | PHGDH | O43175 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5795626 | 0.82 | KDM4E (0.38) | ALDH1A1KDM4EFAAHPHGDHMGLL | |
| SCHEMBL848904 | 0.74 | ALDH1A1 (0.40) | ALDH1A1KDM4EMEN1CYP1A2CYP2D6 | |
| SCHEMBL635998 | 0.71 | MEN1 (0.35) | ALDH1A1KDM4EMEN1CYP1A2CYP2D6 | |
| SCHEMBL10947342 | 0.65 | FAAH (0.41) | ALDH1A1KDM4EMEN1KMT2AFAAH | |
| SCHEMBL5794841 | 0.65 | ALDH1A1 (0.37) | ALDH1A1KDM4EMEN1KMT2AFAAH | |
| SCHEMBL5797685 | 0.64 | CYP1A2 (0.36) | ALDH1A1KDM4EMEN1CYP1A2CYP2D6 | |
| SCHEMBL5798012 | 0.64 | S1PR4 (0.40) | ALDH1A1MEN1KMT2AFAAHPHGDH | |
| SCHEMBL10939398 | 0.64 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2AFAAHPHGDH | |
| SCHEMBL10939347 | 0.64 | ALDH1A1 (0.36) | ALDH1A1CYP1A2FAAHPHGDHMGLL | |
| SCHEMBL146892 | 0.63 | ALDH1A1 (0.58) | ALDH1A1KDM4ECYP1A2HPGDLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006037468-A1 | HIV REVERSE TRANSCRIPTASE INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) | 2006-04-13 | — | — | WO | claimed |