Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | GLS | O94925 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4688931 | 0.86 | TDP1 (0.49) | TDP1GAACTSKNPC1RAB9A | |
| SCHEMBL13739840 | 0.85 | TDP1 (0.58) | TDP1NPC1RAB9ASMN1; SMN2RECQL | |
| SCHEMBL10007438 | 0.84 | TDP1 (0.77) | TDP1NPC1RAB9AHPGDTSHR | |
| SCHEMBL6156228 | 0.82 | STS (0.43) | L3MBTL1LMNA | |
| SCHEMBL8492676 | 0.81 | FFAR1 (0.48) | TDP1GAANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7105678 | 0.81 | TDP1 (0.57) | TDP1NPC1RAB9ASMN1; SMN2L3MBTL1 | |
| SCHEMBL9006857 | 0.81 | TDP1 (0.56) | TDP1NPC1RAB9AL3MBTL1ALDH1A1 | |
| SCHEMBL11525727 | 0.81 | EPHX1 (0.48) | NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL25400902 | 0.81 | CA12 (0.51) | TDP1NPC1RAB9ASMN1; SMN2TSHR | |
| SCHEMBL6674784 | 0.80 | LTA4H (0.51) | SMN1; SMN2ALDH1A1CYP3A4LMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010024762-A1 | PREPARATION OF β-PHENYL-ISOSERINE DERIVATIVES | ORGANOCLICK AKTIEBOLAG (SE) | 2010-03-04 | — | — | WO | disclosed |