Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.58 |
| ▸ | AGXT | P21549 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CHKA | P35790 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 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 | |
|---|---|---|---|---|
| SCHEMBL9467297 | 0.78 | TAAR1 (0.58) | TAAR1AGXTIDO1KCNH2 | |
| SCHEMBL3641300 | 0.78 | TAAR1 (0.62) | TAAR1AGXTIDO1ALOX15SMN1; SMN2 | |
| SCHEMBL363179 | 0.77 | HTR2A (0.54) | TAAR1CYP1A2CYP2A6IDO1GPR52 | |
| SCHEMBL8733231 | 0.75 | CYP1A2 (0.52) | TAAR1CYP1A2CYP2A6AGXTIDO1 | |
| SCHEMBL9583102 | 0.74 | CYP1A2 (0.52) | TAAR1CYP1A2CYP2A6AGXTIDO1 | |
| SCHEMBL6081 | 0.74 | TAAR1 (1.00) | TAAR1CYP1A2CYP2A6BACE1SMN1; SMN2 | |
| SCHEMBL10793330 | 0.74 | GPR52 (0.49) | TAAR1CYP1A2CYP2A6KCNH2GPR52 | |
| SCHEMBL6083273 | 0.73 | CYP1A2 (0.50) | TAAR1CYP1A2CYP2A6AGXTIDO1 | |
| SCHEMBL1611960 | 0.73 | CYP1A2 (0.50) | TAAR1CYP1A2CYP2A6AGXTIDO1 | |
| SCHEMBL8476153 | 0.73 | CYP1A2 (0.50) | TAAR1CYP1A2CYP2A6AGXTIDO1 |
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-5332719-A | Herbicides | BAYER AKTIENGESELLSCHAFT (DE) | 1994-07-26 | — | — | US | disclosed |
| US-5266555-A | Herbicides | BAYER AKTIENGESELLSCHAFT (DE) | 1993-11-30 | — | — | US | disclosed |