Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.72 |
| ▸ | MAOB | P27338 | 3/20 | 0.66 |
| ▸ | CALM1 | P0DP23 | 2/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | HTR1A | P08908 | 1/20 | 0.62 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.62 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | HTR3A | P46098 | 1/20 | 0.62 |
| ▸ | BACE1 | P56817 | 1/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.60 |
| ▸ | BLM | P54132 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| Tyramine SCHEMBL8339170 | 0.95 | TAAR1 (0.81) | TAAR1MAOBCALM1ALDH1A1KDM4E | |
| Tyramine SCHEMBL8418379 | 0.87 | TAAR1 (0.68) | TAAR1MAOBCALM1ALDH1A1KDM4E | |
| SCHEMBL4634 | 0.85 | TAAR1 (1.00) | TAAR1MAOBCALM1KDM4E | |
| SCHEMBL8746062 | 0.83 | CYP19A1 (0.74) | TAAR1MAOBCALM1ALDH1A1TDP1 | |
| Bromide SCHEMBL25228226 | 0.83 | TAAR1 (0.95) | TAAR1MAOBCALM1KDM4E | |
| Iodide SCHEMBL29184237 | 0.83 | TAAR1 (0.95) | TAAR1MAOBCALM1KDM4E | |
| SCHEMBL3414787 | 0.83 | CALM1 (0.84) | TAAR1CALM1CYP19A1NPC1MAPT | |
| SCHEMBL9468301 | 0.83 | TAAR1 (0.95) | TAAR1MAOBCALM1CYP19A1 | |
| Hydrochloric Acid SCHEMBL4473880 | 0.83 | TAAR1 (0.95) | TAAR1MAOBCALM1ALDH1A1TDP1 | |
| Thyronamine SCHEMBL449823 | 0.80 | TAAR1 (0.75) | TAAR1MAOBCALM1ALDH1A1KDM4E |
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-0973936-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 2000-01-26 | — | — | EP | disclosed |
| EP-0946549-A1 | COMBINATORIAL PROCESS FOR PREPARING FUSED PYRIMIDINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998046786-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 1998-10-22 | — | — | WO | disclosed |
| WO-1998027087-A1 | COMBINATORIAL PROCESS FOR PREPARING FUSED PYRIMIDINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-06-25 | — | — | WO | disclosed |