Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8790706 | 1.00 | PBRM1 (0.40) | PBRM1CYP1A2NPSR1LMNACYP2D6 | |
| SCHEMBL8005653 | 0.75 | TAAR1 (0.45) | LMNATSHRTAAR1SLC6A4OPRM1 | |
| SCHEMBL11409371 | 0.73 | HPGD (0.53) | PBRM1CYP1A2NPSR1LMNACYP2D6 | |
| SCHEMBL11409362 | 0.73 | HPGD (0.53) | PBRM1CYP1A2NPSR1LMNACYP2D6 | |
| SCHEMBL31747107 | 0.66 | TDP2 (0.31) | — | |
| SCHEMBL11409456 | 0.65 | HPGD (0.49) | PBRM1CYP1A2LMNAHPGDTAAR1 | |
| SCHEMBL11409452 | 0.65 | HPGD (0.49) | PBRM1CYP1A2LMNAHPGDTAAR1 | |
| SCHEMBL11403068 | 0.63 | MAOA (0.46) | PBRM1CYP1A2NPSR1LMNACYP2D6 | |
| SCHEMBL11403066 | 0.63 | MAOA (0.46) | PBRM1CYP1A2NPSR1LMNACYP2D6 | |
| SCHEMBL12681587 | 0.63 | TSHR (0.38) | TSHROPRM1SMN1; SMN2HTTALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0620809-B1 | $g(a)-SUBSTITUTED BENZENEMETHANAMINE DERIVATIVES | JANSSEN PHARMACEUTICA NV (BE) | 1997-03-05 | — | — | EP | disclosed |
| US-5480912-A | Method of treating HIV-1 with α-substituted benzenemethanamine derivatives | JANSSEN PHARMACEUTICA, N.V. (BE) | 1996-01-02 | — | — | US | disclosed |
| US-5407961-A | Useful for treating HIV-1 virus | JANSSEN PHARMACEUTICA N.V. (BE) | 1995-04-18 | — | — | US | disclosed |
| EP-0620809-A1 | -g(a)-SUBSTITUTED BENZENEMETHANAMINE DERIVATIVES. | JANSSEN PHARMACEUTICA NV (BE) | 1994-10-26 | — | — | EP | disclosed |
| WO-1993013052-A1 | α-SUBSTITUTED BENZENEMETHANAMINE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-07-08 | — | — | WO | disclosed |