Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 1/20 | 0.55 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.54 |
| ▸ | DRD3 | P35462 | 2/20 | 0.50 |
| ▸ | HTR6 | P50406 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.47 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10211721 | 0.80 | HPGD (0.56) | HPGDALDH1A1SMN1; SMN2POLBLMNA | |
| SCHEMBL5690532 | 0.80 | TMEM97 (0.56) | CXCR3TMEM97SIGMAR1HPGDALDH1A1 | |
| SCHEMBL3163275 | 0.79 | HPGD (0.53) | HPGDALDH1A1SMN1; SMN2LMNACYP3A4 | |
| SCHEMBL13051864 | 0.78 | HPGD (0.50) | HPGDALDH1A1SMN1; SMN2LMNACYP3A4 | |
| SCHEMBL29644341 | 0.78 | ABHD6 (0.55) | KDM4EHPGDALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL28739037 | 0.78 | ABHD6 (0.55) | KDM4EHPGDALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL10169287 | 0.77 | HSP90AA1 (0.56) | HPGDALDH1A1SMN1; SMN2LMNACYP3A4 | |
| SCHEMBL5452542 | 0.77 | MEN1 (0.48) | CXCR3TMEM97SIGMAR1DRD2HPGD | |
| SCHEMBL14591397 | 0.77 | CXCR3 (0.56) | CXCR3TMEM97SIGMAR1DRD3HTR6 | |
| SCHEMBL5446306 | 0.76 | TMEM97 (0.67) | CXCR3TMEM97SIGMAR1DRD3HTR6 |
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-7196088-B2 | Substituted tetrahydroisoquinolines and uses thereof | ROCHE PALO ALTO LLC (US) | 2007-03-27 | — | — | US | disclosed |