Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8843274 | 0.86 | KDM4C (0.55) | HDAC1HDAC2HDAC8HDAC6CYP1A2 | |
| Hydrochloric Acid SCHEMBL8843524 | 0.84 | KDM4C (0.54) | HDAC1HDAC2HDAC8HDAC6CYP1A2 | |
| SCHEMBL24943587 | 0.81 | HDAC1 (0.55) | HDAC1HDAC2HDAC8HDAC6CYP1A2 | |
| SCHEMBL12749489 | 0.79 | CYSLTR2 (0.54) | HDAC1HDAC2HDAC8HDAC6CYP1A2 | |
| SCHEMBL5503169 | 0.78 | CYP1A2 (0.63) | HDAC1HDAC2CYP1A2ALDH1A1GAA | |
| SCHEMBL29877127 | 0.78 | CYP1A2 (0.63) | HDAC1HDAC2CYP1A2ALDH1A1GAA | |
| SCHEMBL30388584 | 0.78 | KDM1A (0.50) | HDAC1HDAC2HDAC8HDAC6CYP1A2 | |
| SCHEMBL10616742 | 0.76 | KDM1A (0.49) | HDAC1HDAC2HDAC8HDAC6CYP1A2 | |
| SCHEMBL15578063 | 0.76 | HDAC1 (0.61) | HDAC1HDAC2HDAC8HDAC6CYP1A2 | |
| SCHEMBL1037883 | 0.76 | HDAC1 (0.48) | HDAC1HDAC2HDAC8HDAC6CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008021745-A2 | HEPATITIS C VIRUS ENTRY INHIBITORS | ITHERX PHARMACEUTICALS, INC. (US) | 2008-02-21 | — | — | WO | disclosed |
| US-6399631-B1 | 3-AMIDO OR 3-SULFONAMIDO; EATING DISORDERS IN HUMANS, DOGS AND CATS | PFIZER INC. | 2002-06-04 | — | — | US | disclosed |
| US-5672615-A | MATRIX-DEGRADING METALLOPROTEINASE INHIBITORS | NOVARTIS CORPORATION (US) | 1997-09-30 | — | — | US | disclosed |