Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP9 | P14780 | 11/20 | 0.46 |
| ▸ | MMP8 | P22894 | 11/20 | 0.46 |
| ▸ | MMP12 | P39900 | 11/20 | 0.46 |
| ▸ | MMP13 | P45452 | 11/20 | 0.46 |
| ▸ | MMP14 | P50281 | 11/20 | 0.46 |
| ▸ | MMP2 | P08253 | 10/20 | 0.46 |
| ▸ | MMP1 | P03956 | 9/20 | 0.46 |
| ▸ | MAPT | P10636 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11218389 | 0.98 | MMP9 (0.45) | MMP9MMP8MMP12MMP13MMP14 | |
| SCHEMBL11385692 | 0.84 | ALDH1A1 (0.41) | MMP9MMP8MMP12MMP13MMP14 | |
| Hydrochloric Acid SCHEMBL11381457 | 0.83 | ALDH1A1 (0.40) | MMP9MMP8MMP12MMP13MMP14 | |
| Hydrochloric Acid SCHEMBL11219335 | 0.81 | MMP9 (0.47) | MMP9MMP8MMP12MMP13MMP14 | |
| SCHEMBL21155877 | 0.74 | DYRK1A (0.47) | — | |
| SCHEMBL21156828 | 0.72 | DYRK1A (0.59) | MMP9MMP8MMP12MMP13MMP14 | |
| SCHEMBL21156271 | 0.70 | DYRK1A (0.58) | MAPTGAA | |
| SCHEMBL11224751 | 0.69 | ALOX15 (0.39) | MMP9MMP8MMP12MMP13MMP14 | |
| SCHEMBL21156811 | 0.68 | DYRK1A (0.58) | — | |
| SCHEMBL21156833 | 0.68 | DYRK1A (0.56) | ALDH1A1POLBSMN1; SMN2GAAHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4309426-A | Muscle-relaxant 1,3,4-thiadiazin-2-amines | RICHARDSON-MERRELL INC. (US) | 1982-01-05 | — | — | US | claimed |
| US-4309426-A | Muscle-relaxant 1,3,4-thiadiazin-2-amines | RICHARDSON-MERRELL INC. (US) | 1982-01-05 | — | — | US | disclosed |
| US-4272532-A | SEDATIVES | RICHARDSON-MERRELL INC. (US) | 1981-06-09 | — | — | US | disclosed |