Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.35 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.35 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.33 |
| ▸ | HTR6 | P50406 | 3/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28801289 | 0.84 | FEN1 (0.35) | KDM4ESLC1A3SLC1A2SLC1A1NAPRT | |
| SCHEMBL1278495 | 0.78 | SMN1; SMN2 (0.40) | CYP3A4CYP3A5KDM4ENAPRTHTR6 | |
| SCHEMBL194316 | 0.77 | HTR6 (0.39) | KDM4EHTR6CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL1278632 | 0.77 | KMT2A (0.49) | KDM4ECA12CA1CA2CA9 | |
| Hydrochloric Acid SCHEMBL1278272 | 0.76 | HTR6 (0.39) | KDM4EHTR6CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL22769478 | 0.72 | KDM4E (0.39) | CYP3A4CYP3A5KDM4ENAPRTPTGS2 | |
| SCHEMBL1156646 | 0.71 | KDM4E (0.41) | CYP3A4KDM4ENAPRTPTGS2HTR6 | |
| SCHEMBL17748242 | 0.70 | CHRNB2 (0.38) | CYP3A4CYP3A5KDM4ENAPRTPTGS2 | |
| Methylamine SCHEMBL28637857 | 0.69 | CYP2A6 (0.40) | KDM4ENAPRTPTGS2HTR6CA12 | |
| SCHEMBL1156179 | 0.69 | HTR6 (0.42) | HTR6CYP11B2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113149883-B | Process for preparing pyrrole compounds | 武田药品工业株式会社 | 2024-04-02 | — | — | CN | disclosed |
| US-7498337-B2 | Acid secretion inhibitor | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-03-03 | — | — | US | disclosed |