Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.42 |
| ▸ | NOS1 | P29475 | 2/20 | 0.40 |
| ▸ | NOS2 | P35228 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | ALPL | P05186 | 1/20 | 0.31 |
| ▸ | ALPI | P09923 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4416002 | 0.84 | TAAR1 (0.56) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL4587339 | 0.84 | TAAR1 (0.56) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL4586186 | 0.84 | TAAR1 (0.56) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL10302995 | 0.69 | TAAR1 (0.59) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL248238 | 0.69 | TAAR1 (0.59) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL820194 | 0.69 | TAAR1 (0.59) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL1130128 | 0.69 | TAAR1 (0.59) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL23393910 | 0.67 | TAAR1 (0.47) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL23054771 | 0.67 | TAAR1 (0.47) | TAAR1MAPTALDH1A1NPC1RAB9A | |
| SCHEMBL13788689 | 0.67 | TAAR1 (0.56) | TAAR1MAPTALDH1A1NPC1RAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009067233-A1 | BETA CARBOLINES AND USES THEREOF | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2009-05-28 | — | — | WO | disclosed |