Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.51 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9040350 | 0.95 | AKR1B1 (0.57) | KDM1AAKR1B1TSHRTDP1CASP6 | |
| SCHEMBL8749278 | 0.87 | TSHR (0.54) | KDM1AAKR1B1TSHRTDP1 | |
| SCHEMBL9039535 | 0.85 | AKR1B1 (0.46) | AKR1B1 | |
| SCHEMBL9038348 | 0.83 | AKR1B1 (0.47) | AKR1B1 | |
| SCHEMBL9041006 | 0.80 | AKR1B1 (0.49) | AKR1B1 | |
| SCHEMBL9198597 | 0.78 | AKR1B1 (0.50) | KDM1AAKR1B1TSHRTDP1CASP6 | |
| SCHEMBL9042847 | 0.78 | AKR1B1 (0.41) | AKR1B1 | |
| SCHEMBL9038140 | 0.76 | OPRM1 (0.46) | AKR1B1TSHRTDP1 | |
| SCHEMBL30747315 | 0.73 | TNKS (0.45) | KDM1A | |
| SCHEMBL9038579 | 0.72 | AKR1B1 (0.56) | KDM1AAKR1B1TSHRTDP1CASP6 |
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-0441598-B1 | Spiroisoindole compounds | ZENECA INC (US) | 1996-09-04 | — | — | EP | disclosed |
| US-5098925-A | Neurological disorders in mammals | ICI AMERICAS INC. (US) | 1992-03-24 | — | — | US | disclosed |