Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL18995694 | 0.92 | MAOA (0.59) | MAOAMAOBALDH1A1LMNATSHR | |
| SCHEMBL19289840 | 0.78 | HTT (0.64) | MAOAMAOBALDH1A1HTTLMNA | |
| SCHEMBL62692 | 0.78 | HTT (0.64) | MAOAMAOBALDH1A1HTTLMNA | |
| SCHEMBL62691 | 0.78 | HTT (0.64) | MAOAMAOBALDH1A1HTTLMNA | |
| SCHEMBL353412 | 0.78 | MAOA (0.51) | MAOAMAOBALDH1A1HTTLMNA | |
| SCHEMBL7780082 | 0.76 | ALDH1A1 (0.54) | MAOAMAOBALDH1A1HTTLMNA | |
| SCHEMBL7786849 | 0.76 | ALDH1A1 (0.48) | MAOAMAOBALDH1A1HTTLMNA | |
| SCHEMBL18995758 | 0.76 | ALDH1A1 (0.60) | MAOAMAOBALDH1A1HTTLMNA | |
| SCHEMBL917675 | 0.75 | ALDH1A1 (0.53) | MAOAMAOBALDH1A1HTTLMNA | |
| SCHEMBL10230989 | 0.75 | ALDH1A1 (0.53) | MAOAMAOBALDH1A1HTTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-9682944-B2 | Compounds for use in imaging, diagnosing and/or treatment of diseases of the central nervous system or of tumors | PIRAMAL IMAGING SA (CH) | 2017-06-20 | — | — | US | disclosed |