Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6021351 | 0.87 | TSHR (0.41) | CYP2C19TP53LMNAPOLBTHRB | |
| SCHEMBL9779355 | 0.81 | CYP2C19 (0.43) | CYP2C19TP53LMNAPOLBTHRB | |
| SCHEMBL11534783 | 0.81 | ALOX5 (0.44) | CYP2C19TP53LMNAPOLBTHRB | |
| SCHEMBL9326172 | 0.81 | ALOX5 (0.42) | CYP2C19TP53LMNAPOLBTHRB | |
| Hydrochloric Acid SCHEMBL8845008 | 0.80 | CYP2C19 (0.39) | CYP2C19TP53LMNAPOLBTHRB | |
| SCHEMBL10067953 | 0.78 | MEN1 (0.39) | CYP2C19TP53LMNAPOLBTHRB | |
| SCHEMBL11281241 | 0.77 | CES2 (0.47) | CYP2C19TP53LMNAPOLBTHRB | |
| SCHEMBL11281237 | 0.77 | CES2 (0.47) | CYP2C19TP53LMNAPOLBTHRB | |
| SCHEMBL4693687 | 0.77 | CTSK (0.38) | CYP2C19TP53LMNAPOLBTHRB | |
| Methane SCHEMBL11684216 | 0.77 | CYP2C19 (0.46) | CYP2C19TP53LMNAPOLBTHRB |
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 |
|---|---|---|---|---|---|---|---|
| US-20060018911-A1 | Design of therapeutics and therapeutics | POINTILLISTE, INC. | 2006-01-26 | — | — | US | disclosed |
| WO-2005067980-A2 | DESIGN OF THERAPEUTICS AND THERAPEUTICS | POINTILLISTE, INC. (US) | 2005-07-28 | — | — | WO | disclosed |