Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11489472 | 0.84 | AKT1 (0.44) | RIPK1ADRB2LMNAKMT2A | |
| SCHEMBL11606556 | 0.82 | MAPK1 (0.38) | CYP17A1MITFLMNAHTTKMT2A | |
| SCHEMBL11496175 | 0.81 | SLC6A4 (0.45) | CYP17A1POLBFFAR1 | |
| SCHEMBL11488179 | 0.80 | HTT (0.40) | CYP17A1ADRB2ADRB1ADRB3POLB | |
| SCHEMBL22957833 | 0.78 | RIPK1 (0.58) | RIPK1ALDH1A1LMNAHTTKMT2A | |
| SCHEMBL11487006 | 0.77 | MITF (0.38) | CYP17A1MITFALDH1A1LMNAHTT | |
| SCHEMBL11494471 | 0.77 | HTT (0.38) | CYP17A1MITFALDH1A1LMNAHTT | |
| SCHEMBL24302604 | 0.77 | KMT2A (0.51) | RIPK1ADRB2ADRB1ADRB3LMNA | |
| SCHEMBL11492769 | 0.76 | ALDH1A1 (0.38) | CYP17A1ADRB2ADRB1MITFALDH1A1 | |
| SCHEMBL19993113 | 0.76 | HTT (0.41) | POLBMITFALDH1A1LMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4239759-A | Morpholino containing compounds, compositions and use thereof | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1980-12-16 | — | — | US | disclosed |
| US-4110447-A | Anti-inflammatory (halo-4-biphenylyl)-alkanolamines | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1978-08-29 | — | — | US | disclosed |