Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NOS3 | P29474 | 2/20 | 0.43 |
| ▸ | NOS2 | P35228 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | CCR8 | P51685 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL28936176 | 0.98 | TSHR (0.42) | TSHRSMN1; SMN2NOS3NOS2ALDH1A1 | |
| SCHEMBL13603245 | 0.80 | KDM4E (0.44) | SMN1; SMN2ALDH1A1TDP1MEN1KMT2A | |
| SCHEMBL31481298 | 0.80 | GAA (0.37) | SMN1; SMN2ALDH1A1TDP1MEN1KMT2A | |
| SCHEMBL28146890 | 0.80 | ALDH1A1 (0.37) | TSHRSMN1; SMN2ALDH1A1TDP1MEN1 | |
| SCHEMBL4252080 | 0.80 | MAPT (0.38) | TSHRSMN1; SMN2ALDH1A1TDP1MEN1 | |
| SCHEMBL31347163 | 0.80 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1TDP1MEN1KMT2A | |
| SCHEMBL3218043 | 0.80 | NOS3 (0.50) | TSHRSMN1; SMN2NOS3NOS2ALDH1A1 | |
| SCHEMBL8385465 | 0.80 | CYP3A4 (0.40) | TSHRNOS3NOS2ALDH1A1TDP1 | |
| SCHEMBL28192442 | 0.80 | CYP1A2 (0.39) | TSHRSMN1; SMN2ALDH1A1TDP1MEN1 | |
| SCHEMBL1807427 | 0.80 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1TDP1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997000256-A1 | POLYMORPHIC FORMS OF AN ANGIOTENSIN II ANTAGONIST | MERCK & CO., INC. (US) | 1997-01-03 | — | — | WO | disclosed |
| CN-1077955-A | Hete rocyclic derivatives | FUJISAWA PHARMACEUTICAL CO (JP) | 1993-11-03 | — | — | CN | disclosed |