Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 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 | |
|---|---|---|---|---|
| SCHEMBL7206701 | 0.84 | RAB9A (0.45) | ALOX5KMT2AUSP2TSHRHDAC3 | |
| SCHEMBL7380546 | 0.83 | ALOX5 (0.48) | ALOX5KMT2AMAPK1SMN1; SMN2KDM4E | |
| SCHEMBL10568746 | 0.81 | SMN1; SMN2 (0.50) | ALOX5TSHRHDAC3HDAC1SMN1; SMN2 | |
| SCHEMBL7992967 | 0.78 | ALOX5 (0.56) | ALOX5KMT2AHDAC3MAPK1ADRA1A | |
| SCHEMBL1624984 | 0.78 | HDAC3 (0.67) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL7992970 | 0.77 | SMN1; SMN2 (0.42) | ALOX5HDAC3MAPK1ADRA1AHDAC4 | |
| Hydrochloric Acid SCHEMBL6644828 | 0.77 | HDAC3 (0.64) | HDAC3MAPK1ADRA1AHDAC4SLC6A3 | |
| SCHEMBL7374914 | 0.76 | KMT2A (0.72) | ALOX5KMT2AHDAC3MAPK1ADRA1A | |
| SCHEMBL2201636 | 0.75 | ALOX5 (0.55) | ALOX5KMT2AHDAC3MAPK1ADRA1A | |
| SCHEMBL11958358 | 0.74 | KMT2A (0.51) | KMT2AUSP2SMN1; SMN2FFAR1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0880511-A4 | INTEGRIN RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 1999-06-16 | — | — | EP | disclosed |
| EP-0880511-A1 | INTEGRIN RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 1998-12-02 | — | — | EP | disclosed |
| WO-1997026250-A1 | INTEGRIN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1997-07-24 | — | — | WO | disclosed |