Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | IDO1 | P14902 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2430380 | 0.93 | MEN1 (0.45) | MEN1KMT2AIDO1POLBLMNA | |
| SCHEMBL6604781 | 0.82 | KMT2A (0.56) | MEN1KMT2ALMNAHTTNPSR1 | |
| SCHEMBL20435360 | 0.81 | TAAR1 (0.50) | MEN1KMT2AIDO1APPCYP3A4 | |
| SCHEMBL20287965 | 0.81 | ALDH1A1 (0.44) | MEN1KMT2AIDO1LMNAHTT | |
| SCHEMBL6578267 | 0.81 | CYP3A4 (0.62) | IDO1APPCYP3A4ALDH1A1TP53 | |
| SCHEMBL7668721 | 0.80 | IDO1 (0.52) | IDO1APPCYP3A4ALDH1A1TP53 | |
| SCHEMBL6575981 | 0.79 | MEN1 (0.54) | MEN1KMT2AIDO1POLBLMNA | |
| SCHEMBL9112000 | 0.78 | MEN1 (0.42) | MEN1KMT2AIDO1POLBLMNA | |
| SCHEMBL16589112 | 0.78 | IDO1 (0.47) | MEN1KMT2AIDO1APPCYP3A4 | |
| SCHEMBL20425216 | 0.78 | IDO1 (0.47) | MEN1KMT2AIDO1LMNAHTT |
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-5980860-A | A TROPANE-BASED DERIVATIVE COMPLEXES WITH EITHER TECHNETIUM OR RHENIUM THAT ARE SPECIFIC FOR CENTRAL NERVOUS SYSTEM RECEPTORS | THE TRUSTEES OF UNIVERSITY OF PENNSYLVANIA (US) | 1999-11-09 | — | — | US | disclosed |