Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | FLT1 | P17948 | 1/20 | 0.34 |
| ▸ | FLT4 | P35916 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 2/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15293397 | 0.84 | ALDH1A1 (0.40) | ALDH1A1FLT1FLT4KDRCYP3A4 | |
| SCHEMBL301164 | 0.84 | ACHE (0.33) | ALDH1A1DRD1CYP2A6CYP1A2CYP2C19 | |
| SCHEMBL31566349 | 0.84 | ACHE (0.33) | ALDH1A1DRD1CYP2A6CYP1A2CYP2C19 | |
| SCHEMBL301645 | 0.82 | TDP1 (0.46) | ALDH1A1GAACYP3A4KDM4EDRD1 | |
| SCHEMBL29366742 | 0.82 | TDP1 (0.46) | ALDH1A1GAACYP3A4KDM4EDRD1 | |
| SCHEMBL30142870 | 0.82 | TDP1 (0.46) | ALDH1A1GAACYP3A4KDM4EDRD1 | |
| SCHEMBL9490734 | 0.81 | DRD1 (0.41) | ALDH1A1GAACYP3A4KDM4EDRD1 | |
| Hydrochloric Acid SCHEMBL3452951 | 0.81 | DRD1 (0.31) | DRD1CYP2A6CYP1A2CD44 | |
| SCHEMBL12394364 | 0.80 | TDP1 (0.44) | ALDH1A1GAACYP3A4KDM4EDRD1 | |
| SCHEMBL9267935 | 0.80 | TDP1 (0.44) | ALDH1A1GAACYP3A4KDM4EDRD1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0855390-B1 | A process for producing optically active pyrrolidine derivatives | TAKASAGO PERFUMERY CO LTD (JP) | 2001-10-04 | — | — | EP | disclosed |
| US-5942629-A | HYDROGENATING 3-ACETYL-1-BENZYL-2-PYRROLIDINONE IN PRESENCE OF A COMPLEX FORMED FROM BIDENTATE PHOSPHINE AND RUTHENIUM CATALYST TO PRODUCE INTERMEDIATE, REDUCING THE INTERMEDIATE, MESYLATING OR TOSYLATING THE PRODUCT, FINALLY METHYLAMINATING | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1999-08-24 | — | — | US | disclosed |
| EP-0855390-A1 | A process for producing optically active pyrrolidine derivatives | Takasago International Corporation (JP) | 1998-07-29 | — | — | EP | disclosed |
| US-5587510-A | ASYMMETRICAL HYDROGENATION USING RUTHENIUM-PHOPSHINE COMPLEX AS CATALYSTS | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1996-12-24 | — | — | US | disclosed |