Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA7 | P43166 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3081197 | 0.99 | NPC1 (0.45) | NPC1P2RX4MAOAMAOBCA12 | |
| SCHEMBL8457648 | 0.97 | NPC1 (0.44) | NPC1P2RX4MAOAMAOBCA12 | |
| SCHEMBL198743 | 0.97 | NPC1 (0.44) | NPC1P2RX4MAOAMAOBCA12 | |
| SCHEMBL7979443 | 0.97 | NPC1 (0.44) | NPC1P2RX4MAOAMAOBCA12 | |
| SCHEMBL8514426 | 0.97 | NPC1 (0.44) | NPC1P2RX4MAOAMAOBCA12 | |
| SCHEMBL350738 | 0.97 | NPC1 (0.44) | NPC1P2RX4MAOAMAOBCA12 | |
| Potassium SCHEMBL6510254 | 0.97 | NPC1 (0.44) | NPC1P2RX4MAOAMAOBCA12 | |
| SCHEMBL8513482 | 0.89 | ALDH1A1 (0.49) | NPC1P2RX4MAOAMAOBKDM4E | |
| SCHEMBL10779900 | 0.86 | ADRA1A (0.40) | MAOAMAOBKDM4EALDH1A1TRPA1 | |
| Potassium SCHEMBL9817772 | 0.85 | ADRA1A (0.40) | MAOAMAOBKDM4EALDH1A1TRPA1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0797543-B1 | PROCESS FOR THE TREATMENT OF METAL-CONTAINING WATER AND RECOVERY OF METALS THEREFROM | BUCKMAN LABOR INC (US) | 1999-07-14 | — | — | EP | claimed |
| EP-0737086-B1 | COMPOSITION AND PROCESS FOR REDUCING OR PREVENTING METAL AND ACID CONTAMINATION IN ROCK DRAINAGE | BUCKMAN LABOR INC (US) | 1998-07-29 | — | — | EP | claimed |
| EP-0797543-A1 | PROCESS FOR THE TREATMENT OF METAL-CONTAINING WATER AND RECOVERY OF METALS THEREFROM | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1997-10-01 | — | — | EP | claimed |
| EP-0737086-A1 | COMPOSITION AND PROCESS FOR REDUCING OR PREVENTING METAL AND ACID CONTAMINATION IN ROCK DRAINAGE | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1996-10-16 | — | — | EP | claimed |
| US-5505857-A | ADJUSTMENT PH; WATER POLLUTION CONTROL | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1996-04-09 | — | — | US | claimed |
| WO-1995019320-A1 | PROCESS FOR THE TREATMENT OF METAL-CONTAINING WATER AND RECOVERY OF METALS THEREFROM | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1995-07-20 | — | — | WO | claimed |
| WO-1995017927-A1 | COMPOSITION AND PROCESS FOR REDUCING OR PREVENTING METAL AND ACID CONTAMINATION IN ROCK DRAINAGE | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1995-07-06 | — | — | WO | claimed |