Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | RXRG | P48443 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 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 | |
|---|---|---|---|---|
| SCHEMBL10982252 | 0.91 | CYP4F2 (0.50) | CYP4F2CYP4A11TDP1HRH3F2RL1 | |
| SCHEMBL1587126 | 0.84 | MEN1 (0.45) | CYP4F2CYP4A11TDP1KMT2ACA2 | |
| SCHEMBL13250321 | 0.84 | CYP4F2 (0.49) | CYP4F2CYP4A11TDP1HRH3F2RL1 | |
| SCHEMBL7420345 | 0.84 | CYP4F2 (0.49) | CYP4F2CYP4A11TDP1KMT2AALDH1A1 | |
| SCHEMBL10399807 | 0.84 | CYP4F2 (0.62) | CYP4F2CYP4A11TDP1HRH3F2RL1 | |
| SCHEMBL17066813 | 0.83 | CYP4F2 (0.44) | CYP4F2CYP4A11TDP1HRH3F2RL1 | |
| SCHEMBL15608606 | 0.83 | CYP4F2 (0.44) | CYP4F2CYP4A11TDP1HRH3F2RL1 | |
| SCHEMBL4409312 | 0.83 | CYP4F2 (0.44) | CYP4F2CYP4A11TDP1HRH3F2RL1 | |
| SCHEMBL9326099 | 0.83 | CYP4F2 (0.44) | CYP4F2CYP4A11TDP1HRH3NR1H2 | |
| SCHEMBL9792904 | 0.83 | CYP4F2 (0.44) | CYP4F2CYP4A11TDP1HRH3F2RL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6420418-B1 | INHIBITION AND PREVENTION OF LEUKOCYTE ADHESION; USED TO TREAT ADHESION-MEDIATED DISEASES SUCH AS ASTHMA, ALLERGIC RHINITIS, MULTIPLE SCLEROSIS; ATHEROSCLEROSIS, AND INFLAMMATORY BOWEL DISEASE | MERCK & CO., INC. | 2002-07-16 | — | — | US | disclosed |
| WO-2001012183-A1 | HETEROCYCLE AMIDES AS CELL ADHESION INHIBITORS | MERCK & CO., INC. (US) | 2001-02-22 | — | — | WO | disclosed |