Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.61 |
| ▸ | CES2 | O00748 | 7/20 | 0.58 |
| ▸ | CES1 | P23141 | 6/20 | 0.58 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.58 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.56 |
| ▸ | TNKS | O95271 | 1/20 | 0.56 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.56 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.56 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.56 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.54 |
| ▸ | PGR | P06401 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.50 |
| ▸ | FEN1 | P39748 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9242631 | 0.92 | CES2 (0.68) | AKR1C3CES2CES1PARP10SRD5A2 | |
| SCHEMBL11593624 | 0.90 | AKR1C3 (0.75) | AKR1C3CES2CES1PARP10TNKS | |
| SCHEMBL9250736 | 0.90 | CES2 (0.71) | AKR1C3CES2CES1PARP10SRD5A2 | |
| SCHEMBL4189871 | 0.90 | PARP10 (0.69) | AKR1C3CES2CES1PARP10SRD5A2 | |
| SCHEMBL13567254 | 0.90 | CES2 (0.71) | AKR1C3CES2CES1PARP10SRD5A2 | |
| SCHEMBL2134251 | 0.90 | CES2 (0.71) | AKR1C3CES2CES1PARP10SRD5A2 | |
| SCHEMBL21887184 | 0.88 | AKR1C3 (0.78) | AKR1C3CES2CES1PARP10TNKS | |
| SCHEMBL4520532 | 0.87 | CES2 (0.72) | AKR1C3CES2CES1PARP10TNKS | |
| SCHEMBL11127634 | 0.87 | FFAR1 (0.49) | AKR1C3CES2CES1PARP10SRD5A2 | |
| SCHEMBL11125683 | 0.85 | CES2 (0.57) | AKR1C3CES2CES1PARP10SRD5A2 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4449001-A | Oxy and thioaryl-phenylated aromatic biscyclopentadienones | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1984-05-15 | — | — | US | disclosed |
| US-4400540-A | Oxy and thioaryl-phenylated aromatic biscyclopentadienones | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1983-08-23 | — | — | US | disclosed |
| US-4380619-A | POLYBENZOTHIAZOLES; N-HETEROCYCLIC POLYMERS; SOLUBILITY; HEAT RESISTANCE; AIRCRAFT; AEROSPACE | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1983-04-19 | — | — | US | disclosed |
| US-4375536-A | HEAT RESISTANCE, CROSSLINKING | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION (US) | 1983-03-01 | — | — | US | disclosed |
| US-4147868-A | AEROSPACE POLYMERS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1979-04-03 | — | — | US | disclosed |
| US-4098825-A | ACETYLENE-SUBSTITUTED AROMATIC BENZILS AND ACETYLENE-TERMINATED QUINOXALINE COMPOSITIONS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1978-07-04 | — | — | US | disclosed |
| US-4086232-A | PLASTICIZERS FOR THERMOPLASTIC RESINS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1978-04-25 | — | — | US | disclosed |
| US-4022746-A | CONDENSATION, AROMATIC DIGLYOXYL OR DIBENZIL, ORTHO-DIAMINE | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1977-05-10 | — | — | US | disclosed |
| US-3944614-A | 2,2'-Bis(phenylethynyl-5,5'-diaminobenzidine | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) | 1976-03-16 | — | — | US | disclosed |