Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 3/20 | 0.34 |
| ▸ | NOS1 | P29475 | 3/20 | 0.34 |
| ▸ | NOS2 | P35228 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL9739029 | 0.81 | L3MBTL1 (0.42) | CRHBPCRHR2ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL9737619 | 0.80 | ADORA2B (0.40) | CRHBPCRHR2KMT2AALDH1A1ADORA2B | |
| SCHEMBL14180415 | 0.67 | KMT2A (0.51) | KMT2AALDH1A1MAPTNPC1MAPK1 | |
| SCHEMBL9738814 | 0.67 | NOS3 (0.35) | CRHBPCRHR2NOS3NOS1NOS2 | |
| SCHEMBL10397625 | 0.67 | KMT2A (0.43) | KMT2AALDH1A1KDM4ECYP1A2MAPT | |
| SCHEMBL6336311 | 0.67 | ALDH1A1 (0.41) | KMT2AALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL1576650 | 0.67 | NPC1 (0.62) | KMT2AALDH1A1KDM4ECYP1A2MAPT | |
| SCHEMBL9740905 | 0.66 | POLB (0.40) | CRHBPCRHR2KMT2AALDH1A1ADORA2B | |
| SCHEMBL3825486 | 0.64 | MEN1 (0.42) | KMT2AALDH1A1CYP1A2NPC1MAPK1 | |
| SCHEMBL7464556 | 0.64 | ALDH1A1 (0.55) | KMT2AALDH1A1KDM4EMAPTHPGD |
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-5086177-A | Chemical intermediate for herbicides | BAYER AKTIENGESELLSCHAFT (DE) | 1992-02-04 | — | — | US | disclosed |
| US-4980469-A | Reacting isothiourea of nitrogen containing heterocycle with hydroxylamine derivative | BAYER AKTIENGESELLSCHAFT (DE) | 1990-12-25 | — | — | US | disclosed |