Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | CTRB1 | P17538 | 3/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.40 |
| ▸ | CTSG | P08311 | 2/20 | 0.40 |
| ▸ | CMA1 | P23946 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL887412 | 0.82 | SMN1; SMN2 (0.49) | ALDH1A1CYP1A2CYP3A4TSHRLMNA | |
| SCHEMBL887450 | 0.77 | CTSK (0.53) | TSHRCTSSCTSKS1PR3SMN1; SMN2 | |
| SCHEMBL887431 | 0.71 | CA12 (0.46) | ALDH1A1CA1CA2 | |
| SCHEMBL6963259 | 0.71 | LMNA (0.56) | ALDH1A1CYP1A2CYP3A4TSHRLMNA | |
| SCHEMBL27453160 | 0.71 | MAPT (0.54) | ALDH1A1CTRB1PRSS1CTSGCMA1 | |
| SCHEMBL25366914 | 0.70 | TACR3 (0.59) | ALDH1A1CYP1A2CYP3A4TSHRLMNA | |
| SCHEMBL28319764 | 0.70 | TDP1 (0.43) | ALDH1A1CYP1A2TSHRLMNACTRB1 | |
| SCHEMBL9848833 | 0.70 | ALDH1A1 (0.55) | ALDH1A1CYP1A2CYP3A4TSHRLMNA | |
| SCHEMBL1649573 | 0.70 | CA1 (0.69) | ALDH1A1CYP1A2CYP3A4TSHRLMNA | |
| SCHEMBL18232126 | 0.70 | CA1 (0.69) | ALDH1A1CYP1A2CYP3A4TSHRLMNA |
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-7902207-B2 | Process for production of amines | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2011-03-08 | — | — | US | disclosed |