Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6996131 | 0.90 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2HTTCYP1A2CYP3A4 | |
| SCHEMBL6992010 | 0.87 | ALDH1A1 (0.42) | ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL6994808 | 0.84 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2HTTCYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL6998355 | 0.84 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2MAPK1CYP1A2CYP3A4 | |
| SCHEMBL6991542 | 0.83 | PAX8 (0.59) | ALDH1A1SMN1; SMN2LMNANPSR1MAPK1 | |
| SCHEMBL6989440 | 0.83 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2LMNANPSR1POLB | |
| SCHEMBL6992104 | 0.79 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2HTTCYP1A2CYP3A4 | |
| SCHEMBL6999642 | 0.77 | PAX8 (0.60) | ALDH1A1SMN1; SMN2LMNANPSR1MAPK1 | |
| SCHEMBL6990888 | 0.76 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2NPSR1MAPK1CYP1A2 | |
| SCHEMBL6996076 | 0.76 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2LMNANPSR1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0927177-B1 | NOVEL BENZOTHIOPHENE DERIVATIVES, THEIR PREPARATION AND USE AS UROKINASE INHIBITORS | FUJISAWA PHARMACEUTICAL CO (JP) | 2003-11-26 | — | — | EP | disclosed |
| US-6274619-B1 | FUSED AMIDINO TYPE COMPOUNDS SUCH AS 4-(N-BUTYLCARBAMOYLMETHYLIDENE)-2-AMIDINO-4,5,6,7-TETRAHYDROBE NZO(B)THIOPHENE | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-08-14 | — | — | US | disclosed |