Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | NISCH | Q9Y2I1 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HTR5A | P47898 | 1/20 | 0.40 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 5/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.38 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14581535 | 0.88 | TAAR1 (0.55) | TAAR1HTTPTK2BPNMTADRA2A | |
| Hydrochloric Acid SCHEMBL4792618 | 0.87 | TAAR1 (0.57) | TAAR1HTTPTK2BPNMTADRA2A | |
| SCHEMBL6823728 | 0.81 | ADRA2A (0.38) | TAAR1KDM4EHTTPTK2BADRA2A | |
| SCHEMBL4793578 | 0.79 | TAAR1 (0.51) | TAAR1NISCHHTTPTK2BPNMT | |
| Hydrochloric Acid SCHEMBL4792338 | 0.78 | TAAR1 (0.54) | TAAR1NISCHHTTPTK2BPNMT | |
| SCHEMBL14581525 | 0.78 | TAAR1 (0.45) | TAAR1NISCHKDM4EHTR5ANR2E1 | |
| SCHEMBL31020934 | 0.78 | TAAR1 (0.45) | TAAR1NISCHKDM4EHTR5ANR2E1 | |
| Hydrochloric Acid SCHEMBL4791753 | 0.76 | TAAR1 (0.48) | TAAR1NISCHKDM4EHTR5ANR2E1 | |
| SCHEMBL8814257 | 0.76 | NISCH (0.52) | TAAR1NISCHKDM4EHTR5ANR2E1 | |
| SCHEMBL8802563 | 0.76 | NISCH (0.56) | TAAR1NISCHKDM4EHTR5ANR2E1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0751770-A4 | 8-SUBSTITUTED TETRAHYDRO-BETA-CARBOLINES | LILLY CO ELI (US) | 1997-06-11 | — | — | EP | disclosed |
| EP-0751770-A1 | 8-SUBSTITUTED TETRAHYDRO-BETA-CARBOLINES | ELI LILLY AND COMPANY (US) | 1997-01-08 | — | — | EP | disclosed |
| WO-1995024191-A1 | 8-SUBSTITUTED TETRAHYDRO-BETA-CARBOLINES | ELI LILLY AND COMPANY (US) | 1995-09-14 | — | — | WO | disclosed |