Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 4/20 | 0.40 |
| ▸ | CCND1 | P24385 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.31 |
| ▸ | PRKCG | P05129 | 1/20 | 0.31 |
| ▸ | PRKCB | P05771 | 1/20 | 0.31 |
| ▸ | PRKCA | P17252 | 1/20 | 0.31 |
| ▸ | PRKACA | P17612 | 1/20 | 0.31 |
| ▸ | PRKACG | P22612 | 1/20 | 0.31 |
| ▸ | PRKACB | P22694 | 1/20 | 0.31 |
| ▸ | PRKCH | P24723 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5604171 | 0.98 | CDK4 (0.39) | CDK4CCND1KMT2AHTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL5601183 | 0.78 | MAPK1 (0.30) | CDK4CCND1MAPK1 | |
| Hydrochloric Acid SCHEMBL5603900 | 0.78 | CDK4 (0.30) | CDK4CCND1 | |
| Hydrochloric Acid SCHEMBL5602283 | 0.78 | CDK4 (0.30) | CDK4CCND1 | |
| Hydrochloric Acid SCHEMBL5604161 | 0.78 | CDK4 (0.32) | CDK4CCND1TSHRL3MBTL1PRKD3 | |
| SCHEMBL5604165 | 0.74 | CDK4 (0.31) | CDK4CCND1 | |
| Hydrochloric Acid SCHEMBL5603574 | 0.72 | OXTR (0.35) | MCHR2 | |
| Hydrochloric Acid SCHEMBL5600310 | 0.72 | MCHR2 (0.39) | MCHR2MCHR1 | |
| Hydrochloric Acid SCHEMBL5600452 | 0.71 | MCHR2 (0.33) | KMT2ATSHRMCHR2MCHR1 | |
| Hydrochloric Acid SCHEMBL5600050 | 0.68 | OXTR (0.35) | — |
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-20050261449-A1 | Heterocyclic substituted metallocene compounds for olefin polymerization | EXXONMOBIL CHEMICAL PATENT INC. | 2005-11-24 | — | — | US | disclosed |