Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | MTR | Q99707 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TDP2 | O95551 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | GALK1 | P51570 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8648323 | 0.85 | SIGMAR1 (0.48) | ALDH1A1MTRKMT2ARAB9AADRA1D | |
| SCHEMBL8644510 | 0.84 | DRD2 (0.45) | RAB9ANPC1DRD2DRD4DRD5 | |
| SCHEMBL8648283 | 0.83 | DRD2 (0.44) | ALDH1A1RAB9ANPC1DRD2DRD4 | |
| SCHEMBL8649737 | 0.82 | NPC1 (0.49) | ALDH1A1CYP2C19RAB9AADRA1DADRA1A | |
| Fumaric Acid SCHEMBL8650993 | 0.82 | NPC1 (0.42) | RAB9ANPC1DRD2DRD4DRD5 | |
| SCHEMBL8646575 | 0.82 | NPC1 (0.47) | ALDH1A1KMT2ARAB9ACCR5NPC1 | |
| Fumaric Acid SCHEMBL8647009 | 0.81 | NPC1 (0.43) | RAB9ANPC1DRD2DRD4DRD5 | |
| Fumaric Acid SCHEMBL8666121 | 0.80 | NPC1 (0.48) | ALDH1A1KMT2ARAB9ANPC1DRD2 | |
| Fumaric Acid SCHEMBL8667106 | 0.78 | NPC1 (0.44) | ALDH1A1RAB9ACCR5NPC1SMN1; SMN2 | |
| SCHEMBL8644526 | 0.77 | CA9 (0.43) | RAB9ANPC1ATMDRD2DRD4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5773437-A | UROGENITAL DISORDERS SUCH AS DYSURIA | NIPPON CHEMIPHAR CO., LTD. (JP) | 1998-06-30 | — | — | US | disclosed |