Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.40 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9258760 | 0.85 | CYP19A1 (0.39) | RAB9AL3MBTL1CTSBNQO2CYP1A1 | |
| SCHEMBL9251528 | 0.80 | CTSV (0.46) | RAB9ARXFP1MAPTKMT2ANPSR1 | |
| SCHEMBL9254180 | 0.79 | CTSV (0.52) | RAB9AMAPTKMT2ANPSR1KDM4E | |
| SCHEMBL6534525 | 0.76 | CYP1A1 (0.60) | GLAGAANQO2CYP1A1CYP1A2 | |
| SCHEMBL9250550 | 0.72 | KMT2A (0.57) | GAARAB9ACYP1A2RXFP1MAPT | |
| SCHEMBL3888294 | 0.69 | L3MBTL1 (0.55) | RAB9AL3MBTL1CTSBMAPTKMT2A | |
| SCHEMBL9180770 | 0.69 | GAA (0.58) | GLAGAAL3MBTL1NQO2CYP1A1 | |
| Formaldehyde SCHEMBL28320418 | 0.68 | RAB9A (0.51) | RAB9AL3MBTL1CTSBMAPTKMT2A | |
| SCHEMBL909732 | 0.68 | CYP1A1 (0.56) | GLAGAANQO2CYP1A1CYP1A2 | |
| SCHEMBL20605619 | 0.67 | GAA (0.62) | GLAGAAL3MBTL1NQO2CYP1A1 |
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-5393756-A | Treating rheumatoid arthritis or osteoarthritis | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-02-28 | — | — | US | disclosed |
| US-5225418-A | Arthritis | DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1993-07-06 | — | — | US | disclosed |