Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | PTPRC | P08575 | 1/20 | 0.50 |
| ▸ | PTPRG | P23470 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL31366769 | 0.81 | IDO1 (0.58) | ALDH1A1HPGDSMN1; SMN2IDO1CYP3A4 | |
| SCHEMBL3905722 | 0.81 | CYP1A2 (0.62) | CYP1A2SMN1; SMN2IDO1KDM4ECYP2C19 | |
| SCHEMBL1635769 | 0.79 | CYP1A2 (0.60) | CYP1A2ALDH1A1TDP1L3MBTL1SMN1; SMN2 | |
| SCHEMBL15083077 | 0.79 | CYP1A2 (0.65) | CYP1A2ALDH1A1KDM4ECYP3A4CYP2D6 | |
| SCHEMBL2208069 | 0.79 | CYP1A2 (0.60) | CYP1A2ALDH1A1SMN1; SMN2KMT2AIDO1 | |
| SCHEMBL3910561 | 0.79 | CYP1A2 (0.60) | CYP1A2ALDH1A1KDM4ECYP3A4CYP2D6 | |
| SCHEMBL30050703 | 0.79 | CYP1A2 (0.60) | CYP1A2ALDH1A1KDM4ECYP3A4CYP2D6 | |
| SCHEMBL10419640 | 0.79 | CYP1A2 (0.65) | CYP1A2ALDH1A1L3MBTL1HPGDKMT2A | |
| SCHEMBL499117 | 0.79 | CYP2C19 (0.64) | CYP1A2ALDH1A1SMN1; SMN2CYP2C19MAPT | |
| Hydrochloric Acid SCHEMBL3909181 | 0.78 | CYP1A2 (0.59) | CYP1A2ALDH1A1KMT2AKDM4ECYP3A4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110229333-A | A kind of synthetic method of new type polyimide | 湘潭大学 | 2019-09-13 | — | — | CN | disclosed |
| US-5886016-A | ANTIINFLAMMATORY AGENT WITH MINIMAL SIDE EFFECTS FOR TREATING ARTHRITIS | G.D. SEARLE & CO. (US) | 1999-03-23 | — | — | US | disclosed |
| US-5670532-A | Pyrazolyl derivatives for the treatment of inflammation | G. D. SEARLE & CO. (US) | 1997-09-23 | — | — | US | disclosed |
| US-5565482-A | ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS | G.D. SEARLE & CO. (US) | 1996-10-15 | — | — | US | disclosed |
| US-5547975-A | ANTIARTHRIC AGENTS, ANALGESICS AND ANTIPYRETICS; INHIBITORS OF CYCLOOXYGENASE II; SIDE EFFECT REDUCTION | G.D. SEARLE & CO. | 1996-08-20 | — | — | US | disclosed |
| WO-1996009304-A1 | BENZOPYRANOPYRAZOLYL DERIVATIVES FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1996-03-28 | — | — | WO | disclosed |