Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL27649297 | 0.79 | CTSD (0.51) | CTSDHPGDALDH1A1POLBCYP2C19 | |
| SCHEMBL5248182 | 0.78 | SLC6A2 (0.58) | CTSDGLASMN1; SMN2HPGDALDH1A1 | |
| SCHEMBL7475632 | 0.76 | GLA (0.53) | CTSDGLASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL7475644 | 0.76 | GLA (0.53) | CTSDGLASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL7908193 | 0.75 | GLA (0.55) | CTSDGLASMN1; SMN2HPGDALDH1A1 | |
| SCHEMBL7908196 | 0.73 | SMN1; SMN2 (0.55) | CTSDGLASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL505223 | 0.73 | TSHR (0.53) | CTSDGLASMN1; SMN2ALDH1A1CYP2C19 | |
| SCHEMBL8411975 | 0.72 | TSHR (0.51) | CTSDGLAALDH1A1CYP2C19CYP1A2 | |
| SCHEMBL7908199 | 0.72 | TSHR (0.47) | CTSDGLASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL27901687 | 0.72 | TSHR (0.49) | CTSDGLASMN1; SMN2ALDH1A1TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6201119-B1 | 2,3,4,5-TETRAHYDRO-1H-1,4-BENZODIAZEPIN-9-AMINE COMPOUNDS USEFUL AS INTERMEDIATES TO ANTIVIRALS | JANSSEN PHARMACEUTICA N.V. (BE) | 2001-03-13 | — | — | US | disclosed |
| US-5371079-A | Administering to inhibit replication of HIV-1 in human cells | JANSSEN PHARMACEUTICA N.V. (BE) | 1994-12-06 | — | — | US | disclosed |
| US-5270464-A | Anti-HIV-1 tetrahydroimidazo[1,4]benzodiazepin-2-(thi) ones | JANSSEN PHARMACEUTICA N.V. (BE) | 1993-12-14 | — | — | US | disclosed |