Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA7 | P43166 | 2/20 | 0.51 |
| ▸ | CA9 | Q16790 | 2/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.51 |
| ▸ | FAAH | O00519 | 5/20 | 0.47 |
| ▸ | PRKCA | P17252 | 2/20 | 0.46 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 3/20 | 0.43 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4733780 | 0.87 | ESR1 (0.60) | ALDH1A1FAAHPRKCAPRKCDCNR1 | |
| SCHEMBL4734869 | 0.87 | ESR1 (0.60) | ALDH1A1FAAHPRKCAPRKCDCNR1 | |
| SCHEMBL4735045 | 0.87 | ESR1 (0.60) | ALDH1A1FAAHPRKCAPRKCDCNR1 | |
| SCHEMBL4735640 | 0.87 | ESR1 (0.60) | ALDH1A1FAAHPRKCAPRKCDCNR1 | |
| SCHEMBL8970992 | 0.85 | ALDH1A1 (0.58) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL1262159 | 0.85 | ALDH1A1 (0.58) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL6940362 | 0.85 | ALDH1A1 (0.58) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL10397291 | 0.85 | ALDH1A1 (0.58) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL9156502 | 0.85 | ALDH1A1 (0.58) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL10398699 | 0.85 | ALDH1A1 (0.58) | ALDH1A1CA12CA1CA2CA7 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5484585-A | CONTAIN NONIONIC, CATIONIC, ANIONIC, ZWITTERIONIC SURFACTANTS, EXCIPIENTS, AND WATER; X-RAY CONTRAST AND COMPUTED TOMOGRAPHY; MEDICAL DIAGNOSIS | STERLING-WINTHROP INC. (US) | 1996-01-16 | — | — | US | disclosed |
| US-5385720-A | X-ray radiology and computer tomography; uniform coating of the soft tissues; medical diagnosis | STERLING WINTHROP INC. (US) | 1995-01-31 | — | — | US | disclosed |
| EP-0614669-A2 | Compositions of iodobenzoic acid derivatives in filmforming materials for visualization of the gastrointestinal tract | NYCOMED IMAGING AS (NO) | 1994-09-14 | — | — | EP | disclosed |
| EP-0614668-A2 | Composition of iodobenzoic acid derivatives for visualization of the gastrointestinal tract | NYCOMED IMAGING AS (NO) | 1994-09-14 | — | — | EP | disclosed |
| US-5344638-A | Contrast agents for medicine | STERLING WINTHROP INC. (US) | 1994-09-06 | — | — | US | disclosed |
| US-5312616-A | Radiopaque coating for x-ray examination | STERLING WINTHROP INC. (US) | 1994-05-17 | — | — | US | disclosed |