Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | EDNRB | P24530 | 1/20 | 0.32 |
| ▸ | EDNRA | P25101 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30851322 | 0.68 | FABP5 (0.43) | TSHR | |
| SCHEMBL14246789 | 0.68 | POLB (0.35) | POLBTSHRMAPTAKR1C1MAPK1 | |
| SCHEMBL15664981 | 0.68 | ARG1 (0.34) | — | |
| Hydrochloric Acid SCHEMBL25348469 | 0.66 | ARG1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL25348463 | 0.66 | ARG1 (0.33) | — | |
| SCHEMBL4634034 | 0.65 | ARG1 (0.33) | TSHR | |
| SCHEMBL10659624 | 0.65 | ARG1 (0.33) | TSHR | |
| SCHEMBL10989977 | 0.65 | ARG1 (0.33) | TSHR | |
| SCHEMBL3424293 | 0.65 | ARG1 (0.33) | TSHR | |
| SCHEMBL435512 | 0.64 | AKR1C1 (0.48) | AKR1C1HDAC4ALDH1A1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6943224-B2 | Process for preparing supported transition metal catalyst systems and catalyst systems prepared thereby | W. R. GRACE & CO.-CONN. (US) | 2005-09-13 | — | — | US | disclosed |