Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL4767677 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TSHRTDP1NAAAHRH4 | |
| SCHEMBL31342728 | 0.71 | NAAA (0.41) | ALDH1A1TSHRTDP1NAAAHRH4 | |
| SCHEMBL7807145 | 0.70 | TSHR (0.47) | ALDH1A1TSHRTDP1PIN1LMNA | |
| SCHEMBL4765503 | 0.69 | ALDH1A1 (0.46) | ALDH1A1TSHRTDP1HRH4HRH3 | |
| SCHEMBL5427137 | 0.69 | TDP1 (0.64) | ALDH1A1TSHRTDP1NAAAHRH4 | |
| SCHEMBL25594697 | 0.69 | ACHE (0.48) | ALDH1A1TSHRTDP1LMNAL3MBTL1 | |
| SCHEMBL146520 | 0.68 | TSHR (0.64) | ALDH1A1TSHRTDP1NAAAHRH4 | |
| Iodide SCHEMBL28139636 | 0.67 | TSHR (0.61) | ALDH1A1TSHRTDP1NAAAHRH4 | |
| SCHEMBL11544338 | 0.67 | TSHR (0.61) | ALDH1A1TSHRTDP1NAAAHRH4 | |
| SCHEMBL1066576 | 0.66 | TSHR (0.67) | ALDH1A1TSHRTDP1NAAAHRH4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100457756-C | Imidazo-pyrimidines and triazolo-pyrimidines: benzodiazepine receptor ligands | NEUROGEN CORP (US) | 2009-02-04 | — | — | CN | disclosed |
| CN-1826345-A | Imidazo-pyrimidines and triazolo-pyrimidines: benzodiazepine receptor ligands | NEUROGEN CORP A CORP OF THE ST (US) | 2006-08-30 | — | — | CN | disclosed |