Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.72 |
| ▸ | HTR2A | P28223 | 2/20 | 0.57 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.53 |
| ▸ | LTA4H | P09960 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| 4-Phenyl-Butylamine SCHEMBL27597406 | 0.94 | MAOA (0.76) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL8352256 | 0.94 | MAOA (0.68) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| 4-Phenyl-Butylamine SCHEMBL8103485 | 0.87 | MAOA (0.66) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| Benzene SCHEMBL28170833 | 0.87 | MAOA (0.85) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL52482 | 0.87 | MAOA (0.85) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| 4-Phenyl-Butylamine SCHEMBL8353115 | 0.86 | MAOA (0.63) | MAOAHTR2A | |
| 4-Phenyl-Butylamine SCHEMBL8356098 | 0.86 | MAOA (0.63) | MAOAHTR2A | |
| Hydrocinnamyl Alcohol SCHEMBL28833914 | 0.85 | MAOA (0.62) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 | |
| SCHEMBL23421240 | 0.84 | TDP1 (0.67) | MAOAHTR2ASMN1; SMN2TDP1SIGMAR1 | |
| Bromide SCHEMBL5311946 | 0.84 | MAOA (0.81) | MAOAHTR2ACYP2A6SMN1; SMN2TAAR1 |
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-0938676-A1 | COMBINATORIAL PROCESS FOR PREPARING THIAZOLIDINONE LIBRARIES | ELI LILLY AND COMPANY (US) | 1999-09-01 | — | — | EP | disclosed |
| WO-1999002990-A1 | COMBINATORIAL PROCESS FOR PREPARING FUSED SUBSTITUTED PYRIMIDINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1999-01-21 | — | — | WO | disclosed |
| WO-1998021584-A1 | COMBINATORIAL PROCESS FOR PREPARING THIAZOLIDINONE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-05-22 | — | — | WO | disclosed |
| WO-1998008839-A1 | COMBINATORIAL PROCESS FOR PREPARING SUBSTITUTED THIOPHENE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-03-05 | — | — | WO | disclosed |