Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 5/20 | 0.58 |
| ▸ | LMNA | P02545 | 3/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1407465 | 0.89 | CYP1A2 (0.45) | HTTLMNAMAPK1RAB9AACHE | |
| SCHEMBL4032358 | 0.87 | RAB9A (0.54) | HTTLMNAMAPK1RAB9AACHE | |
| SCHEMBL8181917 | 0.87 | HTT (0.59) | HTTLMNAMAPK1RAB9AACHE | |
| SCHEMBL8050011 | 0.84 | HTT (0.65) | HTTLMNAMAPK1RAB9AACHE | |
| SCHEMBL1443452 | 0.82 | LMNA (0.67) | HTTLMNAMAPK1RAB9AACHE | |
| SCHEMBL28217099 | 0.82 | HTT (0.76) | HTTLMNAMAPK1RAB9AACHE | |
| SCHEMBL1407395 | 0.80 | KMT2A (0.58) | HTTLMNAMAPK1RAB9AKMT2A | |
| SCHEMBL8180872 | 0.79 | PIN1 (0.50) | HTTLMNARAB9AKMT2APOLB | |
| SCHEMBL8718343 | 0.79 | KMT2A (0.68) | HTTLMNAMAPK1RAB9AACHE | |
| SCHEMBL5520271 | 0.79 | RAB9A (0.61) | HTTLMNAMAPK1RAB9AACHE |
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-2000063176-A2 | DISUBSTITUTED PYRIDINES AND PYRIMIDINES AS HERBICIDES AND FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-10-26 | — | — | WO | disclosed |