Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 7/20 | 0.65 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.60 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.60 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.51 |
| ▸ | AHCY | P23526 | 3/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8897633 | 0.99 | CYP3A4 (0.67) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A | |
| SCHEMBL8709179 | 0.98 | CYP3A4 (0.65) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A | |
| SCHEMBL8895953 | 0.89 | CYP3A4 (0.54) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A | |
| SCHEMBL385752 | 0.83 | CYP3A4 (0.73) | CYP3A4FGFR1SLC22A6ADORA2AAHCY | |
| SCHEMBL66563 | 0.83 | CYP3A4 (0.73) | CYP3A4FGFR1SLC22A6ADORA2AAHCY | |
| SCHEMBL29437221 | 0.83 | CYP3A4 (0.73) | CYP3A4FGFR1SLC22A6ADORA2AAHCY | |
| SCHEMBL10670033 | 0.81 | FGFR1 (0.65) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A | |
| Pyrophosphoric Acid SCHEMBL10602251 | 0.81 | CYP3A4 (0.55) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A | |
| Tenofovir Anhydrous SCHEMBL27825238 | 0.81 | CYP3A4 (0.98) | CYP3A4CYP2D6 | |
| SCHEMBL8927904 | 0.80 | SLC22A6 (0.70) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5688778-A | VIRICIDES | INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) | 1997-11-18 | — | — | US | claimed |
| US-5837871-A | PHOSPHONATE DERIVATIVES; ANTITUMOR AGENTS, VIRICIDES | INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) | 1998-11-17 | — | — | US | disclosed |
| US-5726174-A | VIRICIDES, ANTITUMOR AGENTS | INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) | 1998-03-10 | — | — | US | disclosed |
| US-5696265-A | ANTIRETROVIRAL; ANTITUNOR AGENT | INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) | 1997-12-09 | — | — | US | disclosed |
| US-5693798-A | ACTIVE AGAINST RETROVIRAL DISEASES; PROPHYLAXIS | INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) | 1997-12-02 | — | — | US | disclosed |
| US-5688778-A | VIRICIDES | INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) | 1997-11-18 | — | — | US | disclosed |
| US-5686611-A | Nucleoside analogs | INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CZ) | 1997-11-11 | — | — | US | disclosed |