Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | HTR1A | P08908 | 5/20 | 0.52 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.52 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | THPO | P40225 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | MTOR | P42345 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL7309646 | 1.00 | KMT2A (0.61) | KMT2APOLBMEN1HTR1AADRB2 | |
| SCHEMBL7320621 | 0.99 | KMT2A (0.62) | KMT2APOLBMEN1HTR1AADRB2 | |
| SCHEMBL7312155 | 0.95 | KMT2A (0.61) | KMT2APOLBMEN1HTR1AADRB2 | |
| SCHEMBL7317641 | 0.82 | ADRB2 (0.67) | HTR1AADRB2ADRB1LMNAADRB3 | |
| SCHEMBL7302638 | 0.82 | ALDH1A1 (0.60) | KMT2AHTR1AADRB2ADRB1LMNA | |
| SCHEMBL7311964 | 0.79 | MAPT (0.57) | KMT2AMEN1HTR1AADRB2ADRB1 | |
| SCHEMBL7309390 | 0.77 | ADRB2 (0.53) | HTR1AADRB2ADRB1LMNAADRB3 | |
| SCHEMBL7309300 | 0.77 | KDM4E (0.48) | KMT2AHTR1AADRB2ADRB1ADRB3 | |
| SCHEMBL7319524 | 0.76 | CASR (0.60) | ADRB2ADRB1ADRB3CYP2D6 | |
| SCHEMBL14027346 | 0.76 | POLB (0.63) | KMT2APOLBMEN1HTR1AADRB2 |
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-4258062-A | ISOPRENALINE ANTAGONISTS EFFECTING HEART RATE AND BLOOD PRESSURE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1981-03-24 | — | — | US | disclosed |
| US-4171370-A | Phenoxy-amino-propanols | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-10-16 | — | — | US | disclosed |