Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PLD2 | O14939 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9337283 | 0.91 | HTT (0.49) | TSHRPOLBNPC1RAB9ATP53 | |
| SCHEMBL9619960 | 0.81 | CA2 (0.42) | CA1CA2SMN1; SMN2 | |
| SCHEMBL13575470 | 0.80 | POLB (0.55) | HTR4POLBNPC1RAB9ATP53 | |
| SCHEMBL13175545 | 0.80 | ALDH1A1 (0.65) | HTR4POLBNPC1RAB9ATP53 | |
| SCHEMBL12505362 | 0.80 | POLB (0.55) | HTR4POLBNPC1RAB9ATP53 | |
| SCHEMBL13575577 | 0.79 | KMT2A (0.53) | TSHRHTR4POLBNPC1RAB9A | |
| SCHEMBL2061387 | 0.79 | ROCK2 (0.60) | TSHRHTR4POLBNPC1RAB9A | |
| SCHEMBL5678384 | 0.79 | SMPD1 (0.60) | TSHRHTR4POLBNPC1RAB9A | |
| SCHEMBL3033838 | 0.79 | TP53 (0.67) | HTR4POLBNPC1RAB9ATP53 | |
| SCHEMBL24938254 | 0.79 | POLB (0.57) | HTR4POLBNPC1RAB9ATP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0641838-B1 | Reactive dye-stuffs on basis of a substituted barbituric acid | BAYER AG (DE) | 1999-11-10 | — | — | EP | disclosed |
| US-5502174-A | Reactive dyestuffs based on a substituted barbituric acid | BAYER AKTIENGESELLSCHAFT (DE) | 1996-03-26 | — | — | US | disclosed |
| EP-0641838-A1 | Reactive dye-stuffs on basis of a substituted barbituric acid | BAYER AG (DE) | 1995-03-08 | — | — | EP | disclosed |