Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PRMT5 | O14744 | 3/20 | 0.47 |
| ▸ | MGMT | P16455 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11220678 | 0.85 | CYP11B2 (0.61) | CYP11B2ALDH1A1TSHRHSD17B10ALOX15 | |
| SCHEMBL11218413 | 0.82 | POLB (0.50) | CYP11B2ALDH1A1TSHRHSD17B10KDM4E | |
| SCHEMBL18489956 | 0.76 | CYP11B2 (1.00) | CYP11B2ALDH1A1TSHRHSD17B10ALOX15 | |
| SCHEMBL10414485 | 0.75 | CYP11B2 (0.58) | CYP11B2ALDH1A1TSHRHSD17B10ALOX15 | |
| SCHEMBL3990390 | 0.75 | CYP11B2 (0.65) | CYP11B2ALDH1A1TSHRHSD17B10ALOX15 | |
| SCHEMBL11229317 | 0.75 | NOS1 (0.58) | ALDH1A1TSHRHSD17B10MAPK1SMN1; SMN2 | |
| SCHEMBL25230198 | 0.74 | CYP11B2 (0.60) | CYP11B2ALDH1A1TSHRHSD17B10ALOX15 | |
| Hydrochloric Acid SCHEMBL6284101 | 0.73 | HTR2C (0.70) | — | |
| SCHEMBL7712443 | 0.72 | MGMT (0.58) | CYP11B2ALDH1A1TSHRHSD17B10ALOX15 | |
| SCHEMBL8131727 | 0.72 | MGMT (0.53) | CYP11B2ALDH1A1TSHRHSD17B10ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| US-4343802-A | ADRENERGIC BLOCKING, ANTIARRYHYTHMIA, AND CARDIOTONIC AGENTS | MERCK, SHARP & DOHME (I.A.) CORP. (US) | 1982-08-10 | — | — | US | disclosed |
| US-4193995-A | B-ADRENERGIC BLOCKING AGENTS | MERCK SHARP & DOHME (I.A.) CORP. (US) | 1980-03-18 | — | — | US | disclosed |
| US-4042586-A | ADRENERGIC BLOCKING AGENTS | MERCK SHARP & DOHME (I.A.) CORPORATION (US) | 1977-08-16 | — | — | US | disclosed |
| US-3946009-A | ADRENERGIC BLOCKING AGENTS | MERCK SHARP & DOHME (I.A.) CORPORATION (US) | 1976-03-23 | — | — | US | disclosed |