Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.49 |
| ▸ | FYN | P06241 | 1/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | AHR | P35869 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL728402 | 0.82 | KMT2A (0.47) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL4488247 | 0.82 | CYP1A2 (0.43) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL27930641 | 0.81 | ALDH1A1 (0.55) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL8724008 | 0.81 | ALDH1A1 (0.43) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL1685061 | 0.81 | GABRA1 (0.45) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL729571 | 0.79 | ALDH1A1 (0.47) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL25430146 | 0.79 | SRD5A1 (0.37) | CYP1A2GABRA1GABRB2CYP3A4SRD5A1 | |
| SCHEMBL25430661 | 0.78 | CYP1A2 (0.47) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL28831011 | 0.78 | ALDH1A1 (0.45) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL4338851 | 0.78 | MEN1 (0.37) | CYP1A2ALDH1A1HPGDHSD17B10THRB |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0539967-B1 | Sensors and methods for sensing | MINNESOTA MINING & MFG (US) | 1998-09-09 | — | — | EP | disclosed |
| US-5498549-A | A FLUORESCENT POLYNUCLEAR COMPOUND COVALENTLY BONDED TO A POLYSILOXANE MATRIX, BLOOD GASES | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1996-03-12 | — | — | US | disclosed |
| US-5409666-A | Quantitative analysis | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-04-25 | — | — | US | disclosed |
| EP-0539967-A1 | Sensors and methods for sensing | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1993-05-05 | — | — | EP | disclosed |
| EP-0528081-A1 | Gas sensor and methods for making and using same | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1993-02-24 | — | — | EP | disclosed |