Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 4/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | DAO | P14920 | 2/20 | 0.34 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.34 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.33 |
| ▸ | DDO | Q99489 | 1/20 | 0.33 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7571309 | 0.88 | GABRA1 (0.43) | GABRA1GABRB2TAAR1HTR1A | |
| SCHEMBL17182701 | 0.86 | GABRA1 (0.37) | GABRA1GABRB2 | |
| SCHEMBL11365142 | 0.82 | GABRA1 (0.50) | GABRA1GABRB2CTSBCLCN2KAT6A | |
| Hydrochloric Acid SCHEMBL28261359 | 0.80 | GABRA1 (0.48) | GABRA1GABRB2CTSBCLCN2KAT6A | |
| SCHEMBL27661263 | 0.78 | GABRA1 (0.71) | GABRA1GABRB2DAODDO | |
| SCHEMBL2052228 | 0.77 | GABRA1 (0.45) | GABRA1GABRB2TAAR1HTR1ACTSB | |
| SCHEMBL10398011 | 0.75 | TSHR (0.42) | GABRA1GABRB2 | |
| Ammonia Solution, Strong SCHEMBL23749095 | 0.75 | GABRA1 (0.43) | GABRA1GABRB2TAAR1HTR1ACTSB | |
| SCHEMBL27657057 | 0.75 | GABRA1 (0.48) | GABRA1GABRB2DAODDO | |
| Hydrochloric Acid SCHEMBL28255119 | 0.75 | GABRA1 (0.43) | GABRA1GABRB2TAAR1HTR1ACTSB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1237844-A1 | PROCESS FOR THE PREPARATION OF SECONDARY AND TERTIARY AMINES | Celgro (US) | 2002-09-11 | — | — | EP | claimed |
| WO-2001044162-A1 | PROCESS FOR THE PREPARATION OF SECONDARY AND TERTIARY AMINES | CELGRO (US) | 2001-06-21 | — | — | WO | claimed |
| US-6107521-A | Process for the preparation of secondary amines | CELGRO (US) | 2000-08-22 | — | — | US | claimed |
| US-6107521-A | Process for the preparation of secondary amines | CELGRO (US) | 2000-08-22 | — | — | US | disclosed |