Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCD | O00767 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.55 |
| ▸ | SNCA | P37840 | 1/20 | 0.54 |
| ▸ | CA5A | P35218 | 1/20 | 0.53 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.53 |
| ▸ | TUBB | P07437 | 1/20 | 0.53 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.53 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.53 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.53 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.53 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.53 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.53 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.53 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.53 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.53 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL1602886 | 0.87 | MEN1 (0.57) | MEN1NPC1RAB9AKMT2APTGS2 | |
| SCHEMBL1602867 | 0.87 | MEN1 (0.60) | MEN1NPC1RAB9AKMT2APTGS2 | |
| SCHEMBL12416497 | 0.86 | ALDH1A1 (0.58) | MEN1NPC1RAB9AKMT2APTGS2 | |
| SCHEMBL15964859 | 0.85 | SCD (0.59) | SCDMEN1NPC1RAB9AKMT2A | |
| SCHEMBL28782136 | 0.84 | MEN1 (0.55) | MEN1NPC1RAB9AKMT2APTGS2 | |
| SCHEMBL27854173 | 0.84 | SCD (0.61) | SCDMEN1KMT2ACA5AALDH1A1 | |
| SCHEMBL13543686 | 0.83 | HSP90AA1 (0.56) | MEN1NPC1RAB9AKMT2APTGS2 | |
| SCHEMBL20344482 | 0.82 | CA5A (0.63) | SCDMEN1KMT2APTGS2CA5A | |
| SCHEMBL1257597 | 0.82 | ALDH1A1 (0.76) | MEN1NPC1RAB9AKMT2APTGS2 | |
| SCHEMBL9857993 | 0.82 | ALDH1A1 (0.63) | SCDMEN1KMT2APTGS2CA5A |
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-3041843-A1 | NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2016-07-13 | — | — | EP | disclosed |
| WO-2015032769-A1 | NOVEL TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2015-03-12 | — | — | WO | disclosed |