Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | PRNP | P04156 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.38 |
| ▸ | NCF1 | P14598 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5797187 | 0.80 | CYP1A2 (0.46) | ALDH1A1HSD17B10CYP1A2PTGS2KDM4E | |
| SCHEMBL31373891 | 0.78 | CYP1A2 (0.45) | ALDH1A1HSD17B10CYP1A2KDM4EPRNP | |
| SCHEMBL28308791 | 0.78 | CYP1A2 (0.45) | ALDH1A1HSD17B10CYP1A2KDM4EPRNP | |
| SCHEMBL9400811 | 0.75 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CYP1A2PTGS2KDM4E | |
| SCHEMBL20023734 | 0.74 | CYP1A2 (0.44) | ALDH1A1CYP1A2KDM4EKMT2ALMNA | |
| SCHEMBL506970 | 0.73 | HTT (0.41) | ALDH1A1HSD17B10KDM4ELMNAHTT | |
| SCHEMBL506969 | 0.73 | HTT (0.41) | ALDH1A1HSD17B10KDM4ELMNAHTT | |
| SCHEMBL1713701 | 0.73 | UGT2B7 (0.50) | CYP1A2KMT2ACA9 | |
| SCHEMBL1261380 | 0.73 | CYP1A2 (0.48) | ALDH1A1HSD17B10CYP1A2KDM4EPRNP | |
| SCHEMBL827081 | 0.73 | CYP1A2 (0.52) | ALDH1A1HSD17B10CYP1A2KDM4EPRNP |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5334719-A | Antihistamines, antiallergens, antiinflammatory agents | MERCK FROSST CANADA, INC. (CA) | 1994-08-02 | — | — | US | disclosed |
| US-5298512-A | Substituted chromans and their use in the treatment of asthma, arthritis and related diseases | PFIZER INC. (US) | 1994-03-29 | — | — | US | disclosed |
| EP-0391625-B1 | Substituted chromans in the treatment of asthma, arthritis and related diseases | PFIZER (US) | 1994-01-26 | — | — | EP | disclosed |
| WO-1993025546-A1 | BICYCLIC(AZAAROMATIC)INDOLES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS | MERCK FROSST CANADA INC. (CA) | 1993-12-23 | — | — | WO | disclosed |
| EP-0391625-A1 | Substituted chromans in the treatment of asthma, arthritis and related diseases | PFIZER INC. (US) | 1990-10-10 | — | — | EP | disclosed |