Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 4/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9185202 | 0.84 | KMT2A (0.46) | BCHEALDH1A1ACHEKDM4EMEN1 | |
| Ammonia Solution, Strong SCHEMBL9182347 | 0.83 | KMT2A (0.45) | BCHEALDH1A1ACHEKDM4EMEN1 | |
| SCHEMBL9177398 | 0.83 | CYP2D6 (0.42) | ALDH1A1CYP2D6FAAHTSHRS1PR5 | |
| SCHEMBL9838655 | 0.81 | ALDH1A1 (0.42) | ALDH1A1CYP2D6TSHRS1PR5S1PR1 | |
| SCHEMBL17512704 | 0.79 | S1PR1 (0.43) | S1PR5S1PR1 | |
| SCHEMBL4481787 | 0.76 | ATM (0.40) | CTSKBACE1ALDH1A1FAAHS1PR5 | |
| SCHEMBL4481788 | 0.76 | ATM (0.40) | CTSKBACE1ALDH1A1FAAHS1PR5 | |
| SCHEMBL4466104 | 0.76 | CHRM3 (0.43) | ALDH1A1S1PR5S1PR1 | |
| SCHEMBL8541686 | 0.73 | SIGMAR1 (0.44) | CTSKKMT2A | |
| SCHEMBL7518231 | 0.73 | NPFFR1 (0.48) | BCHEALDH1A1ACHEKDM4EMEN1 |
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-5391763-A | 3-aza-bicyclo[3.1.0]hexanes which are intermediates for anti-bacterial azabicyclo quinolone carboxylic acids | PFIZER INC. (US) | 1995-02-21 | — | — | US | disclosed |
| US-5266569-A | Azatricyclo carboxylic acids useful as anti-bacterial agents | PFIZER INC. (US) | 1993-11-30 | — | — | US | disclosed |
| US-5229396-A | Anti-bacterial azabicyclo quinolone carboxylic acids | PFIZER INC. (US) | 1993-07-20 | — | — | US | disclosed |
| US-5164402-A | Bactericides | PFIZER INC (US) | 1992-11-17 | — | — | US | disclosed |
| WO-1991002526-A1 | AZABICYCLO QUINOLONE CARBOXYLIC ACIDS | PFIZER INC. (US) | 1991-03-07 | — | — | WO | disclosed |