Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 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 | |
|---|---|---|---|---|
| SCHEMBL22146121 | 0.77 | KDM1A (0.41) | HTTMAPTNPSR1 | |
| SCHEMBL6024930 | 0.73 | ALDH1A1 (0.49) | NPC1RAB9AHPGDALDH1A1TDP1 | |
| SCHEMBL5330982 | 0.72 | MEN1 (0.43) | NPC1RAB9AHPGDALDH1A1ALOX12 | |
| SCHEMBL15271056 | 0.72 | MEN1 (0.43) | NPC1RAB9AHPGDALDH1A1ALOX12 | |
| SCHEMBL1111756 | 0.71 | ALDH1A1 (0.46) | NPC1RAB9AHPGDALDH1A1TDP1 | |
| SCHEMBL22046821 | 0.70 | CNR1 (0.51) | NPC1RAB9AHPGDALDH1A1TDP1 | |
| SCHEMBL15271475 | 0.69 | MEN1 (0.44) | NPC1RAB9AHPGDALDH1A1ALOX12 | |
| SCHEMBL23585613 | 0.69 | DDB1 (0.40) | HPGDALDH1A1TDP1GAAMAPT | |
| SCHEMBL7634561 | 0.68 | GAA (0.61) | NPC1RAB9AALDH1A1ALOX12GAA | |
| SCHEMBL23016004 | 0.68 | GAA (0.61) | NPC1RAB9AALDH1A1ALOX12GAA |
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-0691985-A1 | PHOSPHONOMETHYLDIPEPTIDES | MERRELL PHARMACEUTICALS INC. (US) | 1996-01-17 | — | — | EP | claimed |
| WO-1994022908-A1 | PHOSPHONOMETHYLDIPEPTIDES | MERRELL DOW PHARMACEUTICALS INC. (US) | 1994-10-13 | — | — | WO | claimed |