Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.40 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL8633486 | 0.81 | ALDH1A1 (0.62) | ALDH1A1PKML3MBTL1POLBKMT2A | |
| SCHEMBL2362867 | 0.70 | NAPRT (0.49) | ALDH1A1L3MBTL1KMT2ASMN1; SMN2TSHR | |
| SCHEMBL4018746 | 0.68 | KDR (0.66) | ALDH1A1L3MBTL1POLBSMN1; SMN2TSHR | |
| SCHEMBL2363693 | 0.67 | LMNA (0.49) | ALDH1A1PKML3MBTL1POLBKMT2A | |
| SCHEMBL8081834 | 0.64 | POLB (0.55) | ALDH1A1L3MBTL1POLBKMT2ASMN1; SMN2 | |
| SCHEMBL50429 | 0.64 | TSHR (0.53) | ALDH1A1PKML3MBTL1POLBKMT2A | |
| SCHEMBL4181116 | 0.63 | TSHR (0.64) | ALDH1A1L3MBTL1POLBKMT2ASMN1; SMN2 | |
| SCHEMBL4163380 | 0.62 | TSHR (0.60) | ALDH1A1POLBKMT2ASMN1; SMN2TSHR | |
| SCHEMBL8630241 | 0.62 | L3MBTL1 (1.00) | ALDH1A1PKML3MBTL1KMT2ASMN1; SMN2 | |
| SCHEMBL3421265 | 0.62 | L3MBTL1 (0.79) | ALDH1A1PKML3MBTL1KMT2ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0851771-A2 | N2S2-TYPE BI-FUNCTIONAL NICOTINAMIDE CHELATING AGENTS FOR RADIOACTIVE ISOTOPES | INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) | 1998-07-08 | — | — | EP | disclosed |
| WO-1997010853-A2 | N2S2-TYPE BI-FUNCTIONAL NICOTINAMIDE CHELATING AGENTS FOR RADIOACTIVE ISOTOPES | Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) | 1997-03-27 | — | — | WO | disclosed |