Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.53 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | THRA | P10827 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 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 | |
|---|---|---|---|---|
| SCHEMBL8325433 | 0.82 | HTT (0.67) | HTTLMNAMAPK1RAB9ATAS1R3 | |
| SCHEMBL24476677 | 0.81 | HSP90AA1 (0.66) | HTTLMNAMAPK1RAB9ATAS1R3 | |
| SCHEMBL29797355 | 0.79 | HTT (0.63) | HTTLMNAMAPK1RAB9ATAS1R3 | |
| SCHEMBL4822355 | 0.79 | HTT (0.63) | HTTLMNAMAPK1RAB9ATAS1R3 | |
| SCHEMBL24476979 | 0.76 | HTT (0.55) | HTTLMNAMAPK1RAB9ATAS1R3 | |
| SCHEMBL5729116 | 0.76 | RAB9A (0.63) | HTTLMNAMAPK1RAB9ATAS1R3 | |
| SCHEMBL17261410 | 0.76 | SMPD1 (0.61) | HTTRAB9AACHEKMT2AMEN1 | |
| SCHEMBL29419048 | 0.75 | THRA (0.67) | HTTLMNAMAPK1RAB9ATAS1R3 | |
| SCHEMBL10107772 | 0.75 | THRA (0.67) | HTTLMNAMAPK1RAB9ATAS1R3 | |
| SCHEMBL16945939 | 0.75 | DRD2 (0.64) | TAS1R3TAS1R1ACHEKMT2AMEN1 |
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-1592426-B1 | 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF | NOVARTIS AG (CH) | 2007-12-19 | — | — | EP | disclosed |
| WO-2004069256-A1 | 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF | NOVARTIS AG (CH) | 2004-08-19 | — | — | WO | disclosed |